 Entering Gaussian System, Link 0=g16
 Input=36b_RhEn3-lel2ob_STD_B3LYPDBJ-augccpVDZr.in
 Output=36b_RhEn3-lel2ob_STD_B3LYPDBJ-augccpVDZr.log
 AtFile(1): /user/pierpa/basis_sets/augccpVDZ.gbs
            -H     0
            S    4   1.00
                  1.301000D+01           1.968500D-02
                  1.962000D+00           1.379770D-01
                  4.446000D-01           4.781480D-01
                  1.220000D-01           5.012400D-01
            S    1   1.00
                  1.220000D-01           1.000000D+00
            S    1   1.00
                  0.0297400              1.0000000
            P    1   1.00
                  7.270000D-01           1.0000000
            P    1   1.00
                  0.1410000              1.0000000
            ****
            -He     0
            S    4   1.00
                  3.836000D+01           2.380900D-02
                  5.770000D+00           1.548910D-01
                  1.240000D+00           4.699870D-01
                  2.976000D-01           5.130270D-01
            S    1   1.00
                  2.976000D-01           1.000000D+00
            S    1   1.00
                  0.0725500              1.0000000
            P    1   1.00
                  1.275000D+00           1.0000000
            P    1   1.00
                  0.2473000              1.0000000
            ****
            -Li     0
            S    9   1.00
                  1.469000D+03           7.660000D-04
                  2.205000D+02           5.892000D-03
                  5.026000D+01           2.967100D-02
                  1.424000D+01           1.091800D-01
                  4.581000D+00           2.827890D-01
                  1.580000D+00           4.531230D-01
                  5.640000D-01           2.747740D-01
                  7.345000D-02           9.751000D-03
                  2.805000D-02          -3.180000D-03
            S    9   1.00
                  1.469000D+03          -1.200000D-04
                  2.205000D+02          -9.230000D-04
                  5.026000D+01          -4.689000D-03
                  1.424000D+01          -1.768200D-02
                  4.581000D+00          -4.890200D-02
                  1.580000D+00          -9.600900D-02
                  5.640000D-01          -1.363800D-01
                  7.345000D-02           5.751020D-01
                  2.805000D-02           5.176610D-01
            S    1   1.00
                  2.805000D-02           1.000000D+00
            S    1   1.00
                  8.600000D-03           1.000000D+00
            P    4   1.00
                  1.534000D+00           2.278400D-02
                  2.749000D-01           1.391070D-01
                  7.362000D-02           5.003750D-01
                  2.403000D-02           5.084740D-01
            P    1   1.00
                  2.403000D-02           1.000000D+00
            P    1   1.00
                  5.800000D-03           1.000000D+00
            D    1   1.00
                  1.144000D-01           1.0000000
            D    1   1.00
                  7.330000D-02           1.000000D+00
            ****
            -Be     0
            S    9   1.00
                  2.940000D+03           6.800000D-04
                  4.412000D+02           5.236000D-03
                  1.005000D+02           2.660600D-02
                  2.843000D+01           9.999300D-02
                  9.169000D+00           2.697020D-01
                  3.196000D+00           4.514690D-01
                  1.159000D+00           2.950740D-01
                  1.811000D-01           1.258700D-02
                  5.890000D-02          -3.756000D-03
            S    9   1.00
                  2.940000D+03          -1.230000D-04
                  4.412000D+02          -9.660000D-04
                  1.005000D+02          -4.831000D-03
                  2.843000D+01          -1.931400D-02
                  9.169000D+00          -5.328000D-02
                  3.196000D+00          -1.207230D-01
                  1.159000D+00          -1.334350D-01
                  1.811000D-01           5.307670D-01
                  5.890000D-02           5.801170D-01
            S    1   1.00
                  5.890000D-02           1.000000D+00
            S    1   1.00
                  1.790000D-02           1.000000D+00
            P    4   1.00
                  3.619000D+00           2.911100D-02
                  7.110000D-01           1.693650D-01
                  1.951000D-01           5.134580D-01
                  6.018000D-02           4.793380D-01
            P    1   1.00
                  6.018000D-02           1.000000D+00
            P    1   1.00
                  1.110000D-02           1.000000D+00
            D    1   1.00
                  2.354000D-01           1.0000000
            D    1   1.00
                  7.220000D-02           1.000000D+00
            ****
            -B     0
            S    9   1.00
                  4.570000D+03           6.960000D-04
                  6.859000D+02           5.353000D-03
                  1.565000D+02           2.713400D-02
                  4.447000D+01           1.013800D-01
                  1.448000D+01           2.720550D-01
                  5.131000D+00           4.484030D-01
                  1.898000D+00           2.901230D-01
                  3.329000D-01           1.432200D-02
                  1.043000D-01          -3.486000D-03
            S    9   1.00
                  4.570000D+03          -1.390000D-04
                  6.859000D+02          -1.097000D-03
                  1.565000D+02          -5.444000D-03
                  4.447000D+01          -2.191600D-02
                  1.448000D+01          -5.975100D-02
                  5.131000D+00          -1.387320D-01
                  1.898000D+00          -1.314820D-01
                  3.329000D-01           5.395260D-01
                  1.043000D-01           5.807740D-01
            S    1   1.00
                  1.043000D-01           1.000000D+00
            S    1   1.00
                  0.0310500              1.0000000
            P    4   1.00
                  6.001000D+00           3.548100D-02
                  1.241000D+00           1.980720D-01
                  3.364000D-01           5.052300D-01
                  9.538000D-02           4.794990D-01
            P    1   1.00
                  9.538000D-02           1.000000D+00
            P    1   1.00
                  0.0237800              1.0000000
            D    1   1.00
                  3.430000D-01           1.0000000
            D    1   1.00
                  0.0904000              1.0000000
            ****
            -C     0
            S    9   1.00
                  6.665000D+03           6.920000D-04
                  1.000000D+03           5.329000D-03
                  2.280000D+02           2.707700D-02
                  6.471000D+01           1.017180D-01
                  2.106000D+01           2.747400D-01
                  7.495000D+00           4.485640D-01
                  2.797000D+00           2.850740D-01
                  5.215000D-01           1.520400D-02
                  1.596000D-01          -3.191000D-03
            S    9   1.00
                  6.665000D+03          -1.460000D-04
                  1.000000D+03          -1.154000D-03
                  2.280000D+02          -5.725000D-03
                  6.471000D+01          -2.331200D-02
                  2.106000D+01          -6.395500D-02
                  7.495000D+00          -1.499810D-01
                  2.797000D+00          -1.272620D-01
                  5.215000D-01           5.445290D-01
                  1.596000D-01           5.804960D-01
            S    1   1.00
                  1.596000D-01           1.000000D+00
            S    1   1.00
                  0.0469000              1.0000000
            P    4   1.00
                  9.439000D+00           3.810900D-02
                  2.002000D+00           2.094800D-01
                  5.456000D-01           5.085570D-01
                  1.517000D-01           4.688420D-01
            P    1   1.00
                  1.517000D-01           1.000000D+00
            P    1   1.00
                  0.0404100              1.0000000
            D    1   1.00
                  5.500000D-01           1.0000000
            D    1   1.00
                  0.1510000              1.0000000
            ****
            -N     0
            S    9   1.00
                  9.046000D+03           7.000000D-04
                  1.357000D+03           5.389000D-03
                  3.093000D+02           2.740600D-02
                  8.773000D+01           1.032070D-01
                  2.856000D+01           2.787230D-01
                  1.021000D+01           4.485400D-01
                  3.838000D+00           2.782380D-01
                  7.466000D-01           1.544000D-02
                  2.248000D-01          -2.864000D-03
            S    9   1.00
                  9.046000D+03          -1.530000D-04
                  1.357000D+03          -1.208000D-03
                  3.093000D+02          -5.992000D-03
                  8.773000D+01          -2.454400D-02
                  2.856000D+01          -6.745900D-02
                  1.021000D+01          -1.580780D-01
                  3.838000D+00          -1.218310D-01
                  7.466000D-01           5.490030D-01
                  2.248000D-01           5.788150D-01
            S    1   1.00
                  2.248000D-01           1.000000D+00
            S    1   1.00
                  0.0612400              1.0000000
            P    4   1.00
                  1.355000D+01           3.991900D-02
                  2.917000D+00           2.171690D-01
                  7.973000D-01           5.103190D-01
                  2.185000D-01           4.622140D-01
            P    1   1.00
                  2.185000D-01           1.000000D+00
            P    1   1.00
                  0.0561100              1.0000000
            D    1   1.00
                  8.170000D-01           1.0000000
            D    1   1.00
                  0.2300000              1.0000000
            ****
            -O     0
            S    9   1.00
                  1.172000D+04           7.100000D-04
                  1.759000D+03           5.470000D-03
                  4.008000D+02           2.783700D-02
                  1.137000D+02           1.048000D-01
                  3.703000D+01           2.830620D-01
                  1.327000D+01           4.487190D-01
                  5.025000D+00           2.709520D-01
                  1.013000D+00           1.545800D-02
                  3.023000D-01          -2.585000D-03
            S    9   1.00
                  1.172000D+04          -1.600000D-04
                  1.759000D+03          -1.263000D-03
                  4.008000D+02          -6.267000D-03
                  1.137000D+02          -2.571600D-02
                  3.703000D+01          -7.092400D-02
                  1.327000D+01          -1.654110D-01
                  5.025000D+00          -1.169550D-01
                  1.013000D+00           5.573680D-01
                  3.023000D-01           5.727590D-01
            S    1   1.00
                  3.023000D-01           1.000000D+00
            S    1   1.00
                  0.0789600              1.0000000
            P    4   1.00
                  1.770000D+01           4.301800D-02
                  3.854000D+00           2.289130D-01
                  1.046000D+00           5.087280D-01
                  2.753000D-01           4.605310D-01
            P    1   1.00
                  2.753000D-01           1.000000D+00
            P    1   1.00
                  0.0685600              1.0000000
            D    1   1.00
                  1.185000D+00           1.0000000
            D    1   1.00
                  0.3320000              1.0000000
            ****
            -F     0
            S    9   1.00
                  1.471000D+04           7.210000D-04
                  2.207000D+03           5.553000D-03
                  5.028000D+02           2.826700D-02
                  1.426000D+02           1.064440D-01
                  4.647000D+01           2.868140D-01
                  1.670000D+01           4.486410D-01
                  6.356000D+00           2.647610D-01
                  1.316000D+00           1.533300D-02
                  3.897000D-01          -2.332000D-03
            S    9   1.00
                  1.471000D+04          -1.650000D-04
                  2.207000D+03          -1.308000D-03
                  5.028000D+02          -6.495000D-03
                  1.426000D+02          -2.669100D-02
                  4.647000D+01          -7.369000D-02
                  1.670000D+01          -1.707760D-01
                  6.356000D+00          -1.123270D-01
                  1.316000D+00           5.628140D-01
                  3.897000D-01           5.687780D-01
            S    1   1.00
                  3.897000D-01           1.000000D+00
            S    1   1.00
                  0.0986300              1.0000000
            P    4   1.00
                  2.267000D+01           4.487800D-02
                  4.977000D+00           2.357180D-01
                  1.347000D+00           5.085210D-01
                  3.471000D-01           4.581200D-01
            P    1   1.00
                  3.471000D-01           1.000000D+00
            P    1   1.00
                  0.0850200              1.0000000
            D    1   1.00
                  1.640000D+00           1.0000000
            D    1   1.00
                  0.4640000              1.0000000
            ****
            -Ne     0
            S    9   1.00
                  1.788000D+04           7.380000D-04
                  2.683000D+03           5.677000D-03
                  6.115000D+02           2.888300D-02
                  1.735000D+02           1.085400D-01
                  5.664000D+01           2.909070D-01
                  2.042000D+01           4.483240D-01
                  7.810000D+00           2.580260D-01
                  1.653000D+00           1.506300D-02
                  4.869000D-01          -2.100000D-03
            S    9   1.00
                  1.788000D+04          -1.720000D-04
                  2.683000D+03          -1.357000D-03
                  6.115000D+02          -6.737000D-03
                  1.735000D+02          -2.766300D-02
                  5.664000D+01          -7.620800D-02
                  2.042000D+01          -1.752270D-01
                  7.810000D+00          -1.070380D-01
                  1.653000D+00           5.670500D-01
                  4.869000D-01           5.652160D-01
            S    1   1.00
                  4.869000D-01           1.000000D+00
            S    1   1.00
                  0.1230000              1.0000000
            P    4   1.00
                  2.839000D+01           4.608700D-02
                  6.270000D+00           2.401810D-01
                  1.695000D+00           5.087440D-01
                  4.317000D-01           4.556600D-01
            P    1   1.00
                  4.317000D-01           1.000000D+00
            P    1   1.00
                  0.1064000              1.0000000
            D    1   1.00
                  2.202000D+00           1.0000000
            D    1   1.00
                  0.6310000              1.0000000
            ****
            -Na     0
            S    12   1.00
                  3.170000D+04           4.588780D-04
                  4.755000D+03           3.550700D-03
                  1.082000D+03           1.826180D-02
                  3.064000D+02           7.166500D-02
                  9.953000D+01           2.123460D-01
                  3.542000D+01           4.162030D-01
                  1.330000D+01           3.730200D-01
                  4.392000D+00           6.250540D-02
                  1.676000D+00          -6.245320D-03
                  5.889000D-01           2.433740D-03
                  5.640000D-02          -4.423810D-04
                  2.307000D-02           2.419240D-04
            S    12   1.00
                  3.170000D+04          -1.121620D-04
                  4.755000D+03          -8.685120D-04
                  1.082000D+03          -4.513300D-03
                  3.064000D+02          -1.814360D-02
                  9.953000D+01          -5.807990D-02
                  3.542000D+01          -1.376530D-01
                  1.330000D+01          -1.939080D-01
                  4.392000D+00           8.580090D-02
                  1.676000D+00           6.044190D-01
                  5.889000D-01           4.417190D-01
                  5.640000D-02           1.305470D-02
                  2.307000D-02          -5.680850D-03
            S    12   1.00
                  3.170000D+04           1.701600D-05
                  4.755000D+03           1.306930D-04
                  1.082000D+03           6.877840D-04
                  3.064000D+02           2.723590D-03
                  9.953000D+01           8.955290D-03
                  3.542000D+01           2.078320D-02
                  1.330000D+01           3.193800D-02
                  4.392000D+00          -1.913680D-02
                  1.676000D+00          -1.025950D-01
                  5.889000D-01          -1.989450D-01
                  5.640000D-02           6.559520D-01
                  2.307000D-02           4.311530D-01
            S    1   1.00
                  2.307000D-02           1.000000D+00
            S    1   1.00
                  7.200000D-03           1.000000D+00
            P    8   1.00
                  1.381000D+02           5.796410D-03
                  3.224000D+01           4.157560D-02
                  9.985000D+00           1.628730D-01
                  3.484000D+00           3.594010D-01
                  1.231000D+00           4.499880D-01
                  4.177000D-01           2.275070D-01
                  6.513000D-02           8.082470D-03
                  2.053000D-02          -1.962930D-03
            P    8   1.00
                  1.381000D+02          -5.815310D-04
                  3.224000D+01          -4.073060D-03
                  9.985000D+00          -1.679370D-02
                  3.484000D+00          -3.532680D-02
                  1.231000D+00          -5.219710D-02
                  4.177000D-01          -1.683590D-02
                  6.513000D-02           4.346130D-01
                  2.053000D-02           6.582180D-01
            P    1   1.00
                  2.053000D-02           1.000000D+00
            P    1   1.00
                  5.700000D-03           1.000000D+00
            D    1   1.00
                  9.280000D-02           1.0000000
            D    1   1.00
                  4.800000D-02           1.000000D+00
            ****
            -Mg     0
            S    12   1.00
                  4.739000D+04           3.460230D-04
                  7.108000D+03           2.680770D-03
                  1.618000D+03           1.383670D-02
                  4.584000D+02           5.517670D-02
                  1.493000D+02           1.696600D-01
                  5.359000D+01           3.647030D-01
                  2.070000D+01           4.068560D-01
                  8.384000D+00           1.350890D-01
                  2.542000D+00           4.908840D-03
                  8.787000D-01           2.864600D-04
                  1.077000D-01           2.645900D-05
                  3.999000D-02          -1.127080D-05
            S    12   1.00
                  4.739000D+04          -8.778390D-05
                  7.108000D+03          -6.747250D-04
                  1.618000D+03          -3.556030D-03
                  4.584000D+02          -1.421540D-02
                  1.493000D+02          -4.767480D-02
                  5.359000D+01          -1.148920D-01
                  2.070000D+01          -2.006760D-01
                  8.384000D+00          -3.412240D-02
                  2.542000D+00           5.704540D-01
                  8.787000D-01           5.423090D-01
                  1.077000D-01           2.181280D-02
                  3.999000D-02          -8.277000D-03
            S    12   1.00
                  4.739000D+04           1.696280D-05
                  7.108000D+03           1.298650D-04
                  1.618000D+03           6.888310D-04
                  4.584000D+02           2.735330D-03
                  1.493000D+02           9.312240D-03
                  5.359000D+01           2.232650D-02
                  2.070000D+01           4.111950D-02
                  8.384000D+00           5.456420D-03
                  2.542000D+00          -1.340120D-01
                  8.787000D-01          -2.561760D-01
                  1.077000D-01           6.058560D-01
                  3.999000D-02           5.094460D-01
            S    1   1.00
                  3.999000D-02           1.000000D+00
            S    1   1.00
                  1.420000D-02           1.000000D+00
            P    8   1.00
                  1.799000D+02           5.381610D-03
                  4.214000D+01           3.924180D-02
                  1.313000D+01           1.574450D-01
                  4.628000D+00           3.585350D-01
                  1.670000D+00           4.572260D-01
                  5.857000D-01           2.159180D-01
                  1.311000D-01           6.649480D-03
                  4.112000D-02          -1.253040D-04
            P    8   1.00
                  1.799000D+02          -8.659480D-04
                  4.214000D+01          -6.159780D-03
                  1.313000D+01          -2.615190D-02
                  4.628000D+00          -5.706470D-02
                  1.670000D+00          -8.739060D-02
                  5.857000D-01          -1.229900D-02
                  1.311000D-01           5.020850D-01
                  4.112000D-02           5.972450D-01
            P    1   1.00
                  4.112000D-02           1.000000D+00
            P    1   1.00
                  1.050000D-02           1.000000D+00
            D    1   1.00
                  1.932000D-01           1.0000000
            D    1   1.00
                  6.050000D-02           1.000000D+00
            ****
            -Al     0
            S    12   1.00
                  6.415000D+04           2.902500D-04
                  9.617000D+03           2.250640D-03
                  2.189000D+03           1.164590D-02
                  6.205000D+02           4.673770D-02
                  2.027000D+02           1.462990D-01
                  7.315000D+01           3.302830D-01
                  2.855000D+01           4.158610D-01
                  1.177000D+01           1.892530D-01
                  3.300000D+00           1.158890D-02
                  1.173000D+00          -1.283850D-03
                  1.752000D-01           4.258830D-04
                  6.473000D-02          -1.992800D-04
            S    12   1.00
                  6.415000D+04          -7.580480D-05
                  9.617000D+03          -5.817910D-04
                  2.189000D+03          -3.081130D-03
                  6.205000D+02          -1.231120D-02
                  2.027000D+02          -4.197810D-02
                  7.315000D+01          -1.033710D-01
                  2.855000D+01          -1.963080D-01
                  1.177000D+01          -8.300020D-02
                  3.300000D+00           5.410400D-01
                  1.173000D+00           5.787960D-01
                  1.752000D-01           2.881470D-02
                  6.473000D-02          -9.537950D-03
            S    12   1.00
                  6.415000D+04           1.750780D-05
                  9.617000D+03           1.342080D-04
                  2.189000D+03           7.124420D-04
                  6.205000D+02           2.843300D-03
                  2.027000D+02           9.768420D-03
                  7.315000D+01           2.418500D-02
                  2.855000D+01           4.749930D-02
                  1.177000D+01           2.036210D-02
                  3.300000D+00          -1.587880D-01
                  1.173000D+00          -3.116940D-01
                  1.752000D-01           6.201470D-01
                  6.473000D-02           5.209430D-01
            S    1   1.00
                  6.473000D-02           1.000000D+00
            S    1   1.00
                  0.0231000              1.0000000
            P    8   1.00
                  2.588000D+02           4.068470D-03
                  6.089000D+01           3.068150D-02
                  1.914000D+01           1.291490D-01
                  6.881000D+00           3.208310D-01
                  2.574000D+00           4.538150D-01
                  9.572000D-01           2.750660D-01
                  2.099000D-01           1.908070D-02
                  5.986000D-02          -3.128480D-03
            P    8   1.00
                  2.588000D+02          -7.480530D-04
                  6.089000D+01          -5.457960D-03
                  1.914000D+01          -2.453710D-02
                  6.881000D+00          -5.821380D-02
                  2.574000D+00          -9.837560D-02
                  9.572000D-01          -2.600640D-02
                  2.099000D-01           4.640200D-01
                  5.986000D-02           6.488700D-01
            P    1   1.00
                  5.986000D-02           1.000000D+00
            P    1   1.00
                  0.0153000              1.0000000
            D    1   1.00
                  1.890000D-01           1.0000000
            D    1   1.00
                  0.0535000              1.0000000
            ****
            -Si     0
            S    12   1.00
                  7.886000D+04           2.704430D-04
                  1.182000D+04           2.097170D-03
                  2.692000D+03           1.085060D-02
                  7.634000D+02           4.367540D-02
                  2.496000D+02           1.376530D-01
                  9.028000D+01           3.166440D-01
                  3.529000D+01           4.185810D-01
                  1.451000D+01           2.102120D-01
                  4.053000D+00           1.449520D-02
                  1.482000D+00          -2.035900D-03
                  2.517000D-01           6.241860D-04
                  9.243000D-02          -2.828720D-04
            S    12   1.00
                  7.886000D+04          -7.231770D-05
                  1.182000D+04          -5.551160D-04
                  2.692000D+03          -2.938050D-03
                  7.634000D+02          -1.176870D-02
                  2.496000D+02          -4.029070D-02
                  9.028000D+01          -1.006090D-01
                  3.529000D+01          -1.965280D-01
                  1.451000D+01          -1.023820D-01
                  4.053000D+00           5.271900D-01
                  1.482000D+00           5.932510D-01
                  2.517000D-01           3.326520D-02
                  9.243000D-02          -9.736620D-03
            S    12   1.00
                  7.886000D+04           1.851130D-05
                  1.182000D+04           1.422360D-04
                  2.692000D+03           7.521850D-04
                  7.634000D+02           3.022790D-03
                  2.496000D+02           1.036770D-02
                  9.028000D+01           2.625630D-02
                  3.529000D+01           5.239890D-02
                  1.451000D+01           2.909590D-02
                  4.053000D+00          -1.780030D-01
                  1.482000D+00          -3.468740D-01
                  2.517000D-01           6.230200D-01
                  9.243000D-02           5.377120D-01
            S    1   1.00
                  9.243000D-02           1.000000D+00
            S    1   1.00
                  0.0332000              1.0000000
            P    8   1.00
                  3.159000D+02           3.926560D-03
                  7.442000D+01           2.988110D-02
                  2.348000D+01           1.272120D-01
                  8.488000D+00           3.209430D-01
                  3.217000D+00           4.554290D-01
                  1.229000D+00           2.685630D-01
                  2.964000D-01           1.883360D-02
                  8.768000D-02          -2.624310D-03
            P    8   1.00
                  3.159000D+02          -8.583020D-04
                  7.442000D+01          -6.303280D-03
                  2.348000D+01          -2.882550D-02
                  8.488000D+00          -6.945600D-02
                  3.217000D+00          -1.194930D-01
                  1.229000D+00          -1.995810D-02
                  2.964000D-01           5.102680D-01
                  8.768000D-02           6.003820D-01
            P    1   1.00
                  8.768000D-02           1.000000D+00
            P    1   1.00
                  0.0250000              1.0000000
            D    1   1.00
                  2.750000D-01           1.0000000
            D    1   1.00
                  0.0823000              1.0000000
            ****
            -P     0
            S    12   1.00
                  9.484000D+04           2.555090D-04
                  1.422000D+04           1.981930D-03
                  3.236000D+03           1.027600D-02
                  9.171000D+02           4.148230D-02
                  2.995000D+02           1.319840D-01
                  1.081000D+02           3.086620D-01
                  4.218000D+01           4.206470D-01
                  1.728000D+01           2.228780D-01
                  4.858000D+00           1.640350D-02
                  1.818000D+00          -2.542550D-03
                  3.372000D-01           7.480500D-04
                  1.232000D-01          -3.309630D-04
            S    12   1.00
                  9.484000D+04          -6.969390D-05
                  1.422000D+04          -5.352660D-04
                  3.236000D+03          -2.837090D-03
                  9.171000D+02          -1.139830D-02
                  2.995000D+02          -3.929290D-02
                  1.081000D+02          -9.963640D-02
                  4.218000D+01          -1.979830D-01
                  1.728000D+01          -1.148600D-01
                  4.858000D+00           5.185950D-01
                  1.818000D+00           6.018470D-01
                  3.372000D-01           3.686120D-02
                  1.232000D-01          -9.707590D-03
            S    12   1.00
                  9.484000D+04           1.911990D-05
                  1.422000D+04           1.472230D-04
                  3.236000D+03           7.779120D-04
                  9.171000D+02           3.145460D-03
                  2.995000D+02           1.082000D-02
                  1.081000D+02           2.799570D-02
                  4.218000D+01           5.639780D-02
                  1.728000D+01           3.581900D-02
                  4.858000D+00          -1.933870D-01
                  1.818000D+00          -3.720970D-01
                  3.372000D-01           6.242460D-01
                  1.232000D-01           5.517210D-01
            S    1   1.00
                  1.232000D-01           1.000000D+00
            S    1   1.00
                  0.0417000              1.0000000
            P    8   1.00
                  3.705000D+02           3.950050D-03
                  8.733000D+01           3.024920D-02
                  2.759000D+01           1.295540D-01
                  1.000000D+01           3.275940D-01
                  3.825000D+00           4.569920D-01
                  1.494000D+00           2.530860D-01
                  3.921000D-01           1.687980D-02
                  1.186000D-01          -2.070930D-03
            P    8   1.00
                  3.705000D+02          -9.598320D-04
                  8.733000D+01          -7.111770D-03
                  2.759000D+01          -3.271220D-02
                  1.000000D+01          -7.957840D-02
                  3.825000D+00          -1.350160D-01
                  1.494000D+00          -9.105850D-03
                  3.921000D-01           5.378020D-01
                  1.186000D-01           5.690660D-01
            P    1   1.00
                  1.186000D-01           1.000000D+00
            P    1   1.00
                  0.0343000              1.0000000
            D    1   1.00
                  3.730000D-01           1.0000000
            D    1   1.00
                  0.1130000              1.0000000
            ****
            -S     0
            S    12   1.00
                  1.108000D+05           2.476350D-04
                  1.661000D+04           1.920260D-03
                  3.781000D+03           9.961920D-03
                  1.071000D+03           4.029750D-02
                  3.498000D+02           1.286040D-01
                  1.263000D+02           3.034800D-01
                  4.926000D+01           4.214320D-01
                  2.016000D+01           2.307810D-01
                  5.720000D+00           1.789710D-02
                  2.182000D+00          -2.975160D-03
                  4.327000D-01           8.495220D-04
                  1.570000D-01          -3.679360D-04
            S    12   1.00
                  1.108000D+05          -6.870390D-05
                  1.661000D+04          -5.276810D-04
                  3.781000D+03          -2.796710D-03
                  1.071000D+03          -1.126510D-02
                  3.498000D+02          -3.888340D-02
                  1.263000D+02          -9.950250D-02
                  4.926000D+01          -1.997400D-01
                  2.016000D+01          -1.233600D-01
                  5.720000D+00           5.131940D-01
                  2.182000D+00           6.071200D-01
                  4.327000D-01           3.967530D-02
                  1.570000D-01          -9.468640D-03
            S    12   1.00
                  1.108000D+05           1.990770D-05
                  1.661000D+04           1.534830D-04
                  3.781000D+03           8.095030D-04
                  1.071000D+03           3.289740D-03
                  3.498000D+02           1.129670D-02
                  1.263000D+02           2.963850D-02
                  4.926000D+01           5.998510D-02
                  2.016000D+01           4.132480D-02
                  5.720000D+00          -2.074740D-01
                  2.182000D+00          -3.928890D-01
                  4.327000D-01           6.328400D-01
                  1.570000D-01           5.569240D-01
            S    1   1.00
                  1.570000D-01           1.000000D+00
            S    1   1.00
                  0.0507000              1.0000000
            P    8   1.00
                  3.997000D+02           4.475410D-03
                  9.419000D+01           3.417080D-02
                  2.975000D+01           1.442500D-01
                  1.077000D+01           3.539280D-01
                  4.119000D+00           4.590850D-01
                  1.625000D+00           2.063830D-01
                  4.726000D-01           1.021410D-02
                  1.407000D-01          -6.031220D-05
            P    8   1.00
                  3.997000D+02          -1.162510D-03
                  9.419000D+01          -8.656640D-03
                  2.975000D+01          -3.908860D-02
                  1.077000D+01          -9.346250D-02
                  4.119000D+00          -1.479940D-01
                  1.625000D+00           3.019040D-02
                  4.726000D-01           5.615730D-01
                  1.407000D-01           5.347760D-01
            P    1   1.00
                  1.407000D-01           1.000000D+00
            P    1   1.00
                  0.0399000              1.0000000
            D    1   1.00
                  4.790000D-01           1.0000000
            D    1   1.00
                  0.1520000              1.0000000
            ****
            -Cl     0
            S    12   1.00
                  1.279000D+05           2.411530D-04
                  1.917000D+04           1.870950D-03
                  4.363000D+03           9.708270D-03
                  1.236000D+03           3.931530D-02
                  4.036000D+02           1.259320D-01
                  1.457000D+02           2.993410D-01
                  5.681000D+01           4.218860D-01
                  2.323000D+01           2.372010D-01
                  6.644000D+00           1.915310D-02
                  2.575000D+00          -3.347920D-03
                  5.371000D-01           9.298830D-04
                  1.938000D-01          -3.963790D-04
            S    12   1.00
                  1.279000D+05          -6.789220D-05
                  1.917000D+04          -5.218360D-04
                  4.363000D+03          -2.765130D-03
                  1.236000D+03          -1.115370D-02
                  4.036000D+02          -3.859190D-02
                  1.457000D+02          -9.948480D-02
                  5.681000D+01          -2.013920D-01
                  2.323000D+01          -1.303130D-01
                  6.644000D+00           5.094430D-01
                  2.575000D+00           6.107250D-01
                  5.371000D-01           4.215490D-02
                  1.938000D-01          -9.234270D-03
            S    12   1.00
                  1.279000D+05           2.049860D-05
                  1.917000D+04           1.582980D-04
                  4.363000D+03           8.336390D-04
                  1.236000D+03           3.398800D-03
                  4.036000D+02           1.167380D-02
                  1.457000D+02           3.096220D-02
                  5.681000D+01           6.295330D-02
                  2.323000D+01           4.602570D-02
                  6.644000D+00          -2.193120D-01
                  2.575000D+00          -4.087730D-01
                  5.371000D-01           6.384650D-01
                  1.938000D-01           5.623620D-01
            S    1   1.00
                  1.938000D-01           1.000000D+00
            S    1   1.00
                  0.0608000              1.0000000
            P    8   1.00
                  4.176000D+02           5.259820D-03
                  9.833000D+01           3.983320D-02
                  3.104000D+01           1.646550D-01
                  1.119000D+01           3.873220D-01
                  4.249000D+00           4.570720D-01
                  1.624000D+00           1.516360D-01
                  5.322000D-01           1.816150D-03
                  1.620000D-01           1.882960D-03
            P    8   1.00
                  4.176000D+02          -1.435700D-03
                  9.833000D+01          -1.077960D-02
                  3.104000D+01          -4.700750D-02
                  1.119000D+01          -1.110300D-01
                  4.249000D+00          -1.532750D-01
                  1.624000D+00           8.946090D-02
                  5.322000D-01           5.794440D-01
                  1.620000D-01           4.832720D-01
            P    1   1.00
                  1.620000D-01           1.000000D+00
            P    1   1.00
                  0.0466000              1.0000000
            D    1   1.00
                  6.000000D-01           1.0000000
            D    1   1.00
                  0.1960000              1.0000000
            ****
            -Ar     0
            S    12   1.00
                  1.457000D+05           2.367000D-04
                  2.184000D+04           1.835230D-03
                  4.972000D+03           9.528600D-03
                  1.408000D+03           3.862830D-02
                  4.597000D+02           1.240810D-01
                  1.659000D+02           2.964710D-01
                  6.469000D+01           4.220680D-01
                  2.644000D+01           2.417110D-01
                  7.628000D+00           2.005090D-02
                  2.996000D+00          -3.610000D-03
                  6.504000D-01           9.756070D-04
                  2.337000D-01          -4.113160D-04
            S    12   1.00
                  1.457000D+05          -6.749100D-05
                  2.184000D+04          -5.185220D-04
                  4.972000D+03          -2.748250D-03
                  1.408000D+03          -1.110070D-02
                  4.597000D+02          -3.848200D-02
                  1.659000D+02          -9.975990D-02
                  6.469000D+01          -2.030880D-01
                  2.644000D+01          -1.356080D-01
                  7.628000D+00           5.071950D-01
                  2.996000D+00           6.128980D-01
                  6.504000D-01           4.429680D-02
                  2.337000D-01          -8.992780D-03
            S    12   1.00
                  1.457000D+05           2.104570D-05
                  2.184000D+04           1.625650D-04
                  4.972000D+03           8.554630D-04
                  1.408000D+03           3.497450D-03
                  4.597000D+02           1.201560D-02
                  1.659000D+02           3.213680D-02
                  6.469000D+01           6.552790D-02
                  2.644000D+01           4.993700D-02
                  7.628000D+00          -2.297690D-01
                  2.996000D+00          -4.210060D-01
                  6.504000D-01           6.423310D-01
                  2.337000D-01           5.675400D-01
            S    1   1.00
                  2.337000D-01           1.000000D+00
            S    1   1.00
                  0.0709000              1.0000000
            P    8   1.00
                  4.537000D+02           5.705550D-03
                  1.068000D+02           4.304600D-02
                  3.373000D+01           1.765910D-01
                  1.213000D+01           4.068630D-01
                  4.594000D+00           4.525490D-01
                  1.678000D+00           1.228010D-01
                  5.909000D-01          -4.459960D-03
                  1.852000D-01           2.052250D-03
            P    8   1.00
                  4.537000D+02          -1.606550D-03
                  1.068000D+02          -1.217140D-02
                  3.373000D+01          -5.207890D-02
                  1.213000D+01          -1.237370D-01
                  4.594000D+00          -1.516190D-01
                  1.678000D+00           1.424250D-01
                  5.909000D-01           5.845010D-01
                  1.852000D-01           4.375400D-01
            P    1   1.00
                  1.852000D-01           1.000000D+00
            P    1   1.00
                  0.0533000              1.0000000
            D    1   1.00
                  7.380000D-01           1.0000000
            D    1   1.00
                  0.2400000              1.0000000
            ****
            -Sc     0
            S    20   1.00
                  2.715278D+06           8.147221D-06
                  4.065984D+05           6.334788D-05
                  9.253004D+04           3.330384D-04
                  2.620792D+04           1.404055D-03
                  8.549429D+03           5.081725D-03
                  3.085975D+03           1.626926D-02
                  1.203172D+03           4.624577D-02
                  4.984869D+02           1.137223D-01
                  2.167360D+02           2.257636D-01
                  9.787476D+01           3.106700D-01
                  4.520433D+01           2.191906D-01
                  2.021187D+01           7.215879D-02
                  9.574751D+00           1.187030D-01
                  4.540346D+00           1.220532D-01
                  1.995687D+00           2.136795D-02
                  9.422150D-01          -5.357246D-04
                  4.178450D-01           2.435774D-04
                  9.576100D-02          -8.796617D-05
                  5.135100D-02           7.878246D-05
                  2.387800D-02          -1.637155D-05
            S    20   1.00
                  2.715278D+06          -4.722109D-06
                  4.065984D+05          -3.671829D-05
                  9.253004D+04          -1.930883D-04
                  2.620792D+04          -8.146870D-04
                  8.549429D+03          -2.955526D-03
                  3.085975D+03          -9.520035D-03
                  1.203172D+03          -2.746858D-02
                  4.984869D+02          -6.991528D-02
                  2.167360D+02          -1.499251D-01
                  9.787476D+01          -2.459153D-01
                  4.520433D+01          -2.401293D-01
                  2.021187D+01           3.567987D-02
                  9.574751D+00           4.915023D-01
                  4.540346D+00           4.911381D-01
                  1.995687D+00           9.120633D-02
                  9.422150D-01          -5.356723D-03
                  4.178450D-01           8.812836D-04
                  9.576100D-02          -7.605536D-04
                  5.135100D-02           6.340116D-04
                  2.387800D-02          -1.556163D-04
            S    20   1.00
                  2.715278D+06           9.139905D-07
                  4.065984D+05           7.108513D-06
                  9.253004D+04           3.738126D-05
                  2.620792D+04           1.578828D-04
                  8.549429D+03           5.737686D-04
                  3.085975D+03           1.859244D-03
                  1.203172D+03           5.433182D-03
                  4.984869D+02           1.425387D-02
                  2.167360D+02           3.246144D-02
                  9.787476D+01           6.003454D-02
                  4.520433D+01           6.916105D-02
                  2.021187D+01          -2.113084D-02
                  9.574751D+00          -2.666832D-01
                  4.540346D+00          -4.367591D-01
                  1.995687D+00           6.498243D-02
                  9.422150D-01           7.009599D-01
                  4.178450D-01           4.515562D-01
                  9.576100D-02           3.011910D-02
                  5.135100D-02          -1.329480D-02
                  2.387800D-02           4.633679D-03
            S    20   1.00
                  2.715278D+06          -2.201951D-07
                  4.065984D+05          -1.711419D-06
                  9.253004D+04          -9.008469D-06
                  2.620792D+04          -3.799997D-05
                  8.549429D+03          -1.383227D-04
                  3.085975D+03          -4.473692D-04
                  1.203172D+03          -1.310691D-03
                  4.984869D+02          -3.429860D-03
                  2.167360D+02          -7.847579D-03
                  9.787476D+01          -1.447189D-02
                  4.520433D+01          -1.690669D-02
                  2.021187D+01           5.396115D-03
                  9.574751D+00           6.671062D-02
                  4.540346D+00           1.178356D-01
                  1.995687D+00          -2.738134D-02
                  9.422150D-01          -2.260149D-01
                  4.178450D-01          -3.073539D-01
                  9.576100D-02           2.544054D-01
                  5.135100D-02           5.981590D-01
                  2.387800D-02           3.115202D-01
            S    20   1.00
                  2.715278D+06          -3.757238D-07
                  4.065984D+05          -2.981907D-06
                  9.253004D+04          -1.522586D-05
                  2.620792D+04          -6.684686D-05
                  8.549429D+03          -2.313129D-04
                  3.085975D+03          -7.959729D-04
                  1.203172D+03          -2.161961D-03
                  4.984869D+02          -6.206459D-03
                  2.167360D+02          -1.261905D-02
                  9.787476D+01          -2.739459D-02
                  4.520433D+01          -2.336516D-02
                  2.021187D+01          -5.734627D-03
                  9.574751D+00           1.536025D-01
                  4.540346D+00           1.447100D-01
                  1.995687D+00           9.359699D-02
                  9.422150D-01          -8.687730D-01
                  4.178450D-01           2.114597D-02
                  9.576100D-02           2.275498D+00
                  5.135100D-02          -1.190770D+00
                  2.387800D-02          -7.674257D-01
            S    1   1.00
                  2.387800D-02           1.000000D+00
            S    1   1.00
                  1.110000D-02           1.000000D+00
            P    16   1.00
                  1.059219D+04           4.500000D-05
                  2.507533D+03           4.010000D-04
                  8.144571D+02           2.302000D-03
                  3.115195D+02           1.003700D-02
                  1.319617D+02           3.495400D-02
                  5.998718D+01           9.790900D-02
                  2.866250D+01           2.106800D-01
                  1.410851D+01           3.300930D-01
                  7.103706D+00           3.310270D-01
                  3.609200D+00           1.579600D-01
                  1.776070D+00           2.209900D-02
                  8.547600D-01          -1.605000D-03
                  4.022390D-01          -1.326000D-03
                  1.546650D-01          -2.800000D-04
                  6.494500D-02           3.400000D-05
                  2.635900D-02          -1.300000D-05
            P    16   1.00
                  1.059219D+04          -1.500000D-05
                  2.507533D+03          -1.310000D-04
                  8.144571D+02          -7.570000D-04
                  3.115195D+02          -3.318000D-03
                  1.319617D+02          -1.170600D-02
                  5.998718D+01          -3.360400D-02
                  2.866250D+01          -7.487900D-02
                  1.410851D+01          -1.225480D-01
                  7.103706D+00          -1.302760D-01
                  3.609200D+00           1.459600D-02
                  1.776070D+00           3.091840D-01
                  8.547600D-01           4.629980D-01
                  4.022390D-01           3.049570D-01
                  1.546650D-01           5.087800D-02
                  6.494500D-02          -4.493000D-03
                  2.635900D-02           1.832000D-03
            P    16   1.00
                  1.059219D+04          -4.000000D-06
                  2.507533D+03          -3.200000D-05
                  8.144571D+02          -1.850000D-04
                  3.115195D+02          -8.080000D-04
                  1.319617D+02          -2.870000D-03
                  5.998718D+01          -8.207000D-03
                  2.866250D+01          -1.847300D-02
                  1.410851D+01          -3.010100D-02
                  7.103706D+00          -3.294300D-02
                  3.609200D+00           7.958000D-03
                  1.776070D+00           8.799300D-02
                  8.547600D-01           1.523770D-01
                  4.022390D-01           9.717000D-02
                  1.546650D-01          -2.569380D-01
                  6.494500D-02          -5.878150D-01
                  2.635900D-02          -3.054210D-01
            P    16   1.00
                  1.059219D+04           4.000000D-06
                  2.507533D+03           3.900000D-05
                  8.144571D+02           2.210000D-04
                  3.115195D+02           9.840000D-04
                  1.319617D+02           3.423000D-03
                  5.998718D+01           9.993000D-03
                  2.866250D+01           2.191600D-02
                  1.410851D+01           3.700800D-02
                  7.103706D+00           3.779400D-02
                  3.609200D+00          -4.379000D-03
                  1.776070D+00          -1.101640D-01
                  8.547600D-01          -1.610170D-01
                  4.022390D-01          -1.824820D-01
                  1.546650D-01           3.886110D-01
                  6.494500D-02           6.911000D-01
                  2.635900D-02           7.960400D-02
            P    1   1.00
                  2.635900D-02           1.000000D+00
            P    1   1.00
                  1.066000D-02           1.000000D+00
            D    8   1.00
                  5.051380D+01           4.266000D-03
                  1.474050D+01           2.770800D-02
                  5.195000D+00           1.000010D-01
                  2.028460D+00           2.315810D-01
                  8.040860D-01           3.460330D-01
                  3.076890D-01           3.733740D-01
                  1.113920D-01           2.642880D-01
                  3.735200D-02           6.366700D-02
            D    8   1.00
                  5.051380D+01          -4.389000D-03
                  1.474050D+01          -2.836300D-02
                  5.195000D+00          -1.051370D-01
                  2.028460D+00          -2.348540D-01
                  8.040860D-01          -3.246090D-01
                  3.076890D-01          -6.428900D-02
                  1.113920D-01           6.017490D-01
                  3.735200D-02           3.903000D-01
            D    1   1.00
                  3.735200D-02           1.000000D+00
            D    1   1.00
                  1.244000D-02           1.000000D+00
            F    2   1.00
                  7.126000D-01           3.617450D-01
                  1.636000D-01           8.218680D-01
            F    1   1.00
                  4.063000D-02           1.000000D+00
            ****
            -Ti     0
            S    20   1.00
                  3.014643D+06           8.060782D-06
                  4.514329D+05           6.267518D-05
                  1.027338D+05           3.295006D-04
                  2.909817D+04           1.389203D-03
                  9.492330D+03           5.028469D-03
                  3.426346D+03           1.610419D-02
                  1.335896D+03           4.581232D-02
                  5.535026D+02           1.128613D-01
                  2.406925D+02           2.248193D-01
                  1.087293D+02           3.114571D-01
                  5.026457D+01           2.224995D-01
                  2.258004D+01           7.293128D-02
                  1.071432D+01           1.160683D-01
                  5.093546D+00           1.194774D-01
                  2.244183D+00           2.097868D-02
                  1.059570D+00          -5.091715D-04
                  4.688490D-01           2.217859D-04
                  1.061430D-01          -7.636896D-05
                  5.526200D-02           7.719539D-05
                  2.546500D-02          -1.149056D-05
            S    20   1.00
                  3.014643D+06          -4.630486D-06
                  4.514329D+05          -3.600451D-05
                  1.027338D+05          -1.893420D-04
                  2.909817D+04          -7.988781D-04
                  9.492330D+03          -2.898698D-03
                  3.426346D+03          -9.339701D-03
                  1.335896D+03          -2.697464D-02
                  5.535026D+02          -6.878913D-02
                  2.406925D+02          -1.481037D-01
                  1.087293D+02          -2.445253D-01
                  5.026457D+01          -2.419916D-01
                  2.258004D+01           3.183790D-02
                  1.071432D+01           4.932686D-01
                  5.093546D+00           4.939655D-01
                  2.244183D+00           9.196313D-02
                  1.059570D+00          -5.316992D-03
                  4.688490D-01           8.085624D-04
                  1.061430D-01          -6.918459D-04
                  5.526200D-02           6.086512D-04
                  2.546500D-02          -1.313842D-04
            S    20   1.00
                  3.014643D+06           9.230559D-07
                  4.514329D+05           7.178974D-06
                  1.027338D+05           3.775134D-05
                  2.909817D+04           1.594532D-04
                  9.492330D+03           5.795150D-04
                  3.426346D+03           1.878414D-03
                  1.335896D+03           5.492747D-03
                  5.535026D+02           1.443297D-02
                  2.406925D+02           3.296408D-02
                  1.087293D+02           6.125493D-02
                  5.026457D+01           7.134113D-02
                  2.258004D+01          -1.973150D-02
                  1.071432D+01          -2.741869D-01
                  5.093546D+00          -4.440977D-01
                  2.244183D+00           7.776084D-02
                  1.059570D+00           7.068444D-01
                  4.688490D-01           4.413892D-01
                  1.061430D-01           2.799769D-02
                  5.526200D-02          -1.210790D-02
                  2.546500D-02           4.324762D-03
            S    20   1.00
                  3.014643D+06          -2.180323D-07
                  4.514329D+05          -1.694860D-06
                  1.027338D+05          -8.919208D-06
                  2.909817D+04          -3.763633D-05
                  9.492330D+03          -1.369575D-04
                  3.426346D+03          -4.432894D-04
                  1.335896D+03          -1.298868D-03
                  5.535026D+02          -3.406752D-03
                  2.406925D+02          -7.810829D-03
                  1.087293D+02          -1.449245D-02
                  5.026457D+01          -1.708136D-02
                  2.258004D+01           4.897666D-03
                  1.071432D+01           6.753108D-02
                  5.093546D+00           1.173318D-01
                  2.244183D+00          -2.985025D-02
                  1.059570D+00          -2.277634D-01
                  4.688490D-01          -2.928115D-01
                  1.061430D-01           2.665300D-01
                  5.526200D-02           5.912406D-01
                  2.546500D-02           3.037229D-01
            S    20   1.00
                  3.014643D+06          -3.975126D-07
                  4.514329D+05          -3.161080D-06
                  1.027338D+05          -1.609375D-05
                  2.909817D+04          -7.092947D-05
                  9.492330D+03          -2.442710D-04
                  3.426346D+03          -8.457892D-04
                  1.335896D+03          -2.282208D-03
                  5.535026D+02          -6.619873D-03
                  2.406925D+02          -1.335024D-02
                  1.087293D+02          -2.955830D-02
                  5.026457D+01          -2.477039D-02
                  2.258004D+01          -8.414624D-03
                  1.071432D+01           1.693855D-01
                  5.093546D+00           1.500787D-01
                  2.244183D+00           9.787777D-02
                  1.059570D+00          -9.653608D-01
                  4.688490D-01           1.489721D-01
                  1.061430D-01           2.191179D+00
                  5.526200D-02          -1.243325D+00
                  2.546500D-02          -6.711916D-01
            S    1   1.00
                  2.546500D-02           1.000000D+00
            S    1   1.00
                  1.173000D-02           1.000000D+00
            P    16   1.00
                  1.191203D+04           4.400000D-05
                  2.819947D+03           3.910000D-04
                  9.159479D+02           2.248000D-03
                  3.503842D+02           9.823000D-03
                  1.484825D+02           3.433800D-02
                  6.753944D+01           9.666600D-02
                  3.230332D+01           2.094170D-01
                  1.592786D+01           3.301890D-01
                  8.038035D+00           3.319360D-01
                  4.093916D+00           1.584880D-01
                  2.022390D+00           2.231000D-02
                  9.761020D-01          -1.566000D-03
                  4.595950D-01          -1.324000D-03
                  1.771520D-01          -2.710000D-04
                  7.351700D-02           3.200000D-05
                  2.940100D-02          -1.200000D-05
            P    16   1.00
                  1.191203D+04          -1.500000D-05
                  2.819947D+03          -1.310000D-04
                  9.159479D+02          -7.550000D-04
                  3.503842D+02          -3.319000D-03
                  1.484825D+02          -1.175000D-02
                  6.753944D+01          -3.392200D-02
                  3.230332D+01          -7.616400D-02
                  1.592786D+01          -1.257020D-01
                  8.038035D+00          -1.330980D-01
                  4.093916D+00           1.740600D-02
                  2.022390D+00           3.151650D-01
                  9.761020D-01           4.618140D-01
                  4.595950D-01           2.998560D-01
                  1.771520D-01           5.000000D-02
                  7.351700D-02          -4.230000D-03
                  2.940100D-02           1.725000D-03
            P    16   1.00
                  1.191203D+04           4.000000D-06
                  2.819947D+03           3.100000D-05
                  9.159479D+02           1.820000D-04
                  3.503842D+02           7.950000D-04
                  1.484825D+02           2.833000D-03
                  6.753944D+01           8.154000D-03
                  3.230332D+01           1.847200D-02
                  1.592786D+01           3.040000D-02
                  8.038035D+00           3.304700D-02
                  4.093916D+00          -8.251000D-03
                  2.022390D+00          -8.855400D-02
                  9.761020D-01          -1.496120D-01
                  4.595950D-01          -9.422700D-02
                  1.771520D-01           2.508460D-01
                  7.351700D-02           5.866430D-01
                  2.940100D-02           3.135350D-01
            P    16   1.00
                  1.191203D+04           4.000000D-06
                  2.819947D+03           3.900000D-05
                  9.159479D+02           2.230000D-04
                  3.503842D+02           9.920000D-04
                  1.484825D+02           3.476000D-03
                  6.753944D+01           1.017200D-02
                  3.230332D+01           2.257600D-02
                  1.592786D+01           3.823800D-02
                  8.038035D+00           3.933700D-02
                  4.093916D+00          -6.106000D-03
                  2.022390D+00          -1.129620D-01
                  9.761020D-01          -1.681140D-01
                  4.595950D-01          -1.659320D-01
                  1.771520D-01           3.914030D-01
                  7.351700D-02           6.818400D-01
                  2.940100D-02           8.403100D-02
            P    1   1.00
                  2.940100D-02           1.000000D+00
            P    1   1.00
                  1.176000D-02           1.000000D+00
            D    8   1.00
                  6.401300D+01           3.887000D-03
                  1.881790D+01           2.639900D-02
                  6.728700D+00           9.751100D-02
                  2.664130D+00           2.328480D-01
                  1.078680D+00           3.531520D-01
                  4.232090D-01           3.721860D-01
                  1.559990D-01           2.476720D-01
                  5.188400D-02           5.823600D-02
            D    8   1.00
                  6.401300D+01          -3.970000D-03
                  1.881790D+01          -2.687300D-02
                  6.728700D+00          -1.022750D-01
                  2.664130D+00          -2.377280D-01
                  1.078680D+00          -3.121140D-01
                  4.232090D-01          -4.237800D-02
                  1.559990D-01           5.886580D-01
                  5.188400D-02           4.103020D-01
            D    1   1.00
                  5.188400D-02           1.000000D+00
            D    1   1.00
                  1.726000D-02           1.000000D+00
            F    2   1.00
                  1.227400D+00           3.581580D-01
                  2.788000D-01           8.257940D-01
            F    1   1.00
                  8.266000D-02           1.000000D+00
            ****
            -V     0
            S    20   1.00
                  3.321857D+06           8.039999D-06
                  4.974356D+05           6.251402D-05
                  1.132027D+05           3.286553D-04
                  3.206333D+04           1.385697D-03
                  1.045962D+04           5.016217D-03
                  3.775506D+03           1.606931D-02
                  1.472040D+03           4.574242D-02
                  6.099331D+02           1.128544D-01
                  2.652634D+02           2.254344D-01
                  1.198607D+02           3.140461D-01
                  5.544891D+01           2.267819D-01
                  2.498372D+01           7.334069D-02
                  1.188056D+01           1.102474D-01
                  5.660311D+00           1.131358D-01
                  2.495703D+00           1.971295D-02
                  1.177866D+00          -4.719088D-04
                  5.200440D-01           1.861606D-04
                  1.159650D-01          -6.208598D-05
                  5.893800D-02           7.295314D-05
                  2.694600D-02          -6.362062D-06
            S    20   1.00
                  3.321857D+06          -4.503003D-06
                  4.974356D+05          -3.501295D-05
                  1.132027D+05          -1.841339D-04
                  3.206333D+04          -7.769216D-04
                  1.045962D+04          -2.819505D-03
                  3.775506D+03          -9.087486D-03
                  1.472040D+03          -2.627134D-02
                  6.099331D+02          -6.712726D-02
                  2.652634D+02          -1.451130D-01
                  1.198607D+02          -2.412483D-01
                  5.544891D+01          -2.416314D-01
                  2.498372D+01           3.067362D-02
                  1.188056D+01           4.970415D-01
                  5.660311D+00           4.958875D-01
                  2.495703D+00           9.181868D-02
                  1.177866D+00          -5.392514D-03
                  5.200440D-01           7.102380D-04
                  1.159650D-01          -6.363128D-04
                  5.893800D-02           5.979932D-04
                  2.694600D-02          -1.100879D-04
            S    20   1.00
                  3.321857D+06           9.320648D-07
                  4.974356D+05           7.249306D-06
                  1.132027D+05           3.811967D-05
                  3.206333D+04           1.610238D-04
                  1.045962D+04           5.852210D-04
                  3.775506D+03           1.897502D-03
                  1.472040D+03           5.550909D-03
                  6.099331D+02           1.460584D-02
                  2.652634D+02           3.342974D-02
                  1.198607D+02           6.235722D-02
                  5.544891D+01           7.312435D-02
                  2.498372D+01          -1.911472D-02
                  1.188056D+01          -2.817249D-01
                  5.660311D+00          -4.488151D-01
                  2.495703D+00           9.202696D-02
                  1.177866D+00           7.110117D-01
                  5.200440D-01           4.309274D-01
                  1.159650D-01           2.604589D-02
                  5.893800D-02          -1.101049D-02
                  2.694600D-02           4.106300D-03
            S    20   1.00
                  3.321857D+06          -2.158944D-07
                  4.974356D+05          -1.678519D-06
                  1.132027D+05          -8.831213D-06
                  3.206333D+04          -3.727769D-05
                  1.045962D+04          -1.356099D-04
                  3.775506D+03          -4.392351D-04
                  1.472040D+03          -1.286948D-03
                  6.099331D+02          -3.382149D-03
                  2.652634D+02          -7.765646D-03
                  1.198607D+02          -1.447985D-02
                  5.544891D+01          -1.715502D-02
                  2.498372D+01           4.610101D-03
                  1.188056D+01           6.827831D-02
                  5.660311D+00           1.161368D-01
                  2.495703D+00          -3.277049D-02
                  1.177866D+00          -2.280000D-01
                  5.200440D-01          -2.793991D-01
                  1.159650D-01           2.771165D-01
                  5.893800D-02           5.852999D-01
                  2.694600D-02           2.963946D-01
            S    20   1.00
                  3.321857D+06          -4.093416D-07
                  4.974356D+05          -3.258956D-06
                  1.132027D+05          -1.656390D-05
                  3.206333D+04          -7.316689D-05
                  1.045962D+04          -2.512784D-04
                  3.775506D+03          -8.732657D-04
                  1.472040D+03          -2.347654D-03
                  6.099331D+02          -6.853150D-03
                  2.652634D+02          -1.376420D-02
                  1.198607D+02          -3.084679D-02
                  5.544891D+01          -2.562208D-02
                  2.498372D+01          -1.005123D-02
                  1.188056D+01           1.795330D-01
                  5.660311D+00           1.522400D-01
                  2.495703D+00           9.483887D-02
                  1.177866D+00          -1.014876D+00
                  5.200440D-01           2.308810D-01
                  1.159650D-01           2.113321D+00
                  5.893800D-02          -1.253048D+00
                  2.694600D-02          -6.139502D-01
            S    1   1.00
                  2.694600D-02           1.000000D+00
            S    1   1.00
                  1.232000D-02           1.000000D+00
            P    16   1.00
                  1.327320D+04           4.300000D-05
                  3.142126D+03           3.840000D-04
                  1.020588D+03           2.210000D-03
                  3.904407D+02           9.678000D-03
                  1.655043D+02           3.393600D-02
                  7.532006D+01           9.591700D-02
                  3.605503D+01           2.088530D-01
                  1.780436D+01           3.306600D-01
                  9.002929D+00           3.323120D-01
                  4.594544D+00           1.581880D-01
                  2.276760D+00           2.225200D-02
                  1.101178D+00          -1.565000D-03
                  5.186380D-01          -1.353000D-03
                  2.005650D-01          -2.650000D-04
                  8.129100D-02           2.900000D-05
                  3.179500D-02          -1.100000D-05
            P    16   1.00
                  1.327320D+04          -1.500000D-05
                  3.142126D+03          -1.310000D-04
                  1.020588D+03          -7.550000D-04
                  3.904407D+02          -3.325000D-03
                  1.655043D+02          -1.181100D-02
                  7.532006D+01          -3.425600D-02
                  3.605503D+01          -7.736300D-02
                  1.780436D+01          -1.284560D-01
                  9.002929D+00          -1.350780D-01
                  4.594544D+00           2.083800D-02
                  2.276760D+00           3.204990D-01
                  1.101178D+00           4.602600D-01
                  5.186380D-01           2.953460D-01
                  2.005650D-01           4.904600D-02
                  8.129100D-02          -3.824000D-03
                  3.179500D-02           1.585000D-03
            P    16   1.00
                  1.327320D+04           4.000000D-06
                  3.142126D+03           3.200000D-05
                  1.020588D+03           1.830000D-04
                  3.904407D+02           8.020000D-04
                  1.655043D+02           2.862000D-03
                  7.532006D+01           8.287000D-03
                  3.605503D+01           1.887000D-02
                  1.780436D+01           3.130700D-02
                  9.002929D+00           3.366000D-02
                  4.594544D+00          -9.479000D-03
                  2.276760D+00          -9.231300D-02
                  1.101178D+00          -1.489890D-01
                  5.186380D-01          -8.364400D-02
                  2.005650D-01           2.493390D-01
                  8.129100D-02           5.805150D-01
                  3.179500D-02           3.223800D-01
            P    16   1.00
                  1.327320D+04           4.000000D-06
                  3.142126D+03           3.900000D-05
                  1.020588D+03           2.230000D-04
                  3.904407D+02           9.960000D-04
                  1.655043D+02           3.498000D-03
                  7.532006D+01           1.029600D-02
                  3.605503D+01           2.296200D-02
                  1.780436D+01           3.920800D-02
                  9.002929D+00           3.994300D-02
                  4.594544D+00          -7.121000D-03
                  2.276760D+00          -1.162250D-01
                  1.101178D+00          -1.694960D-01
                  5.186380D-01          -1.553740D-01
                  2.005650D-01           3.950220D-01
                  8.129100D-02           6.789080D-01
                  3.179500D-02           8.312200D-02
            P    1   1.00
                  3.179500D-02           1.000000D+00
            P    1   1.00
                  1.244000D-02           1.000000D+00
            D    8   1.00
                  7.761150D+01           3.595000D-03
                  2.291590D+01           2.521000D-02
                  8.279540D+00           9.478600D-02
                  3.309930D+00           2.303630D-01
                  1.358630D+00           3.528940D-01
                  5.413500D-01           3.704140D-01
                  2.023560D-01           2.457180D-01
                  6.756800D-02           6.099300D-02
            D    8   1.00
                  7.761150D+01          -3.818000D-03
                  2.291590D+01          -2.671700D-02
                  8.279540D+00          -1.036900D-01
                  3.309930D+00          -2.476890D-01
                  1.358630D+00          -3.115230D-01
                  5.413500D-01          -2.282700D-02
                  2.023560D-01           5.697260D-01
                  6.756800D-02           4.194930D-01
            D    1   1.00
                  6.756800D-02           1.000000D+00
            D    1   1.00
                  2.256000D-02           1.000000D+00
            F    2   1.00
                  1.748800D+00           3.900680D-01
                  4.057000D-01           8.008410D-01
            F    1   1.00
                  1.311200D-01           1.000000D+00
            ****
            -Cr     0
            S    20   1.00
                  6.177194D+06           4.128667D-06
                  9.249295D+05           3.210767D-05
                  2.104865D+05           1.688416D-04
                  5.962005D+04           7.128520D-04
                  1.945076D+04           2.589325D-03
                  7.022056D+03           8.377350D-03
                  2.738763D+03           2.441725D-02
                  1.135814D+03           6.365135D-02
                  4.950923D+02           1.427618D-01
                  2.247487D+02           2.541275D-01
                  1.053836D+02           3.009512D-01
                  5.019359D+01           1.766513D-01
                  2.224957D+01           6.936709D-02
                  1.098265D+01           1.179579D-01
                  5.383665D+00           8.916187D-02
                  2.343685D+00           1.103630D-02
                  1.105202D+00          -3.546048D-04
                  4.878480D-01           1.057311D-04
                  8.959900D-02           1.114640D-05
                  3.342300D-02           2.661387D-05
            S    20   1.00
                  6.177194D+06          -2.301772D-06
                  9.249295D+05          -1.789536D-05
                  2.104865D+05          -9.416174D-05
                  5.962005D+04          -3.975074D-04
                  1.945076D+04          -1.447025D-03
                  7.022056D+03          -4.694622D-03
                  2.738763D+03          -1.382387D-02
                  1.135814D+03          -3.674643D-02
                  4.950923D+02          -8.647185D-02
                  2.247487D+02          -1.696735D-01
                  1.053836D+02          -2.507089D-01
                  5.019359D+01          -1.961156D-01
                  2.224957D+01           1.457244D-01
                  1.098265D+01           5.466706D-01
                  5.383665D+00           3.979434D-01
                  2.343685D+00           5.277007D-02
                  1.105202D+00          -4.374537D-03
                  4.878480D-01           3.204035D-04
                  8.959900D-02          -5.142077D-05
                  3.342300D-02           1.584134D-04
            S    20   1.00
                  6.177194D+06           4.862957D-07
                  9.249295D+05           3.776645D-06
                  2.104865D+05           1.990664D-05
                  5.962005D+04           8.389164D-05
                  1.945076D+04           3.065706D-04
                  7.022056D+03           9.944107D-04
                  2.738763D+03           2.961959D-03
                  1.135814D+03           7.969473D-03
                  4.950923D+02           1.955017D-02
                  2.247487D+02           4.085035D-02
                  1.053836D+02           6.929003D-02
                  5.019359D+01           6.146984D-02
                  2.224957D+01          -6.981302D-02
                  1.098265D+01          -3.517597D-01
                  5.383665D+00          -3.828629D-01
                  2.343685D+00           2.676401D-01
                  1.105202D+00           7.175950D-01
                  4.878480D-01           3.020814D-01
                  8.959900D-02           7.749514D-03
                  3.342300D-02           2.696096D-04
            S    20   1.00
                  6.177194D+06          -1.102451D-07
                  9.249295D+05          -8.530233D-07
                  2.104865D+05          -4.520358D-06
                  5.962005D+04          -1.891612D-05
                  1.945076D+04          -6.974344D-05
                  7.022056D+03          -2.237867D-04
                  2.738763D+03          -6.754503D-04
                  1.135814D+03          -1.789346D-03
                  4.950923D+02          -4.477858D-03
                  2.247487D+02          -9.140144D-03
                  1.053836D+02          -1.610562D-02
                  5.019359D+01          -1.334870D-02
                  2.224957D+01           1.426027D-02
                  1.098265D+01           8.931690D-02
                  5.383665D+00           8.885279D-02
                  2.343685D+00          -6.368776D-02
                  1.105202D+00          -2.783262D-01
                  4.878480D-01          -1.830071D-01
                  8.959900D-02           6.790937D-01
                  3.342300D-02           4.672953D-01
            S    20   1.00
                  6.177194D+06           2.179893D-07
                  9.249295D+05           1.612940D-06
                  2.104865D+05           9.111842D-06
                  5.962005D+04           3.500645D-05
                  1.945076D+04           1.435315D-04
                  7.022056D+03           4.035896D-04
                  2.738763D+03           1.425177D-03
                  1.135814D+03           3.114009D-03
                  4.950923D+02           9.814449D-03
                  2.247487D+02           1.474698D-02
                  1.053836D+02           3.911512D-02
                  5.019359D+01           9.170888D-03
                  2.224957D+01           1.559878D-02
                  1.098265D+01          -2.816844D-01
                  5.383665D+00          -6.895261D-03
                  2.343685D+00          -1.769781D-01
                  1.105202D+00           1.443061D+00
                  4.878480D-01          -1.029318D+00
                  8.959900D-02          -1.307667D+00
                  3.342300D-02           1.503842D+00
            S    1   1.00
                  3.342300D-02           1.000000D+00
            S    1   1.00
                  1.247000D-02           1.000000D+00
            P    16   1.00
                  1.445420D+04           4.400000D-05
                  3.421676D+03           3.890000D-04
                  1.111387D+03           2.241000D-03
                  4.251918D+02           9.821000D-03
                  1.802623D+02           3.447100D-02
                  8.206117D+01           9.746000D-02
                  3.929726D+01           2.119850D-01
                  1.941959D+01           3.339900D-01
                  9.828899D+00           3.301370D-01
                  5.016810D+00           1.522270D-01
                  2.487091D+00           2.042500D-02
                  1.198780D+00          -1.360000D-03
                  5.586950D-01          -1.195000D-03
                  2.089240D-01          -1.970000D-04
                  8.460800D-02           2.300000D-05
                  3.325800D-02          -9.000000D-06
            P    16   1.00
                  1.445420D+04          -1.500000D-05
                  3.421676D+03          -1.350000D-04
                  1.111387D+03          -7.770000D-04
                  4.251918D+02          -3.427000D-03
                  1.802623D+02          -1.218900D-02
                  8.206117D+01          -3.538800D-02
                  3.929726D+01          -7.991500D-02
                  1.941959D+01          -1.323350D-01
                  9.828899D+00          -1.354010D-01
                  5.016810D+00           3.200800D-02
                  2.487091D+00           3.338490D-01
                  1.198780D+00           4.617730D-01
                  5.586950D-01           2.812900D-01
                  2.089240D-01           4.184300D-02
                  8.460800D-02          -4.002000D-03
                  3.325800D-02           1.521000D-03
            P    16   1.00
                  1.445420D+04           4.000000D-06
                  3.421676D+03           3.200000D-05
                  1.111387D+03           1.850000D-04
                  4.251918D+02           8.100000D-04
                  1.802623D+02           2.906000D-03
                  8.206117D+01           8.391000D-03
                  3.929726D+01           1.919300D-02
                  1.941959D+01           3.156400D-02
                  9.828899D+00           3.341700D-02
                  5.016810D+00          -1.290700D-02
                  2.487091D+00          -9.365900D-02
                  1.198780D+00          -1.499770D-01
                  5.586950D-01          -6.723400D-02
                  2.089240D-01           2.707590D-01
                  8.460800D-02           5.758070D-01
                  3.325800D-02           3.011210D-01
            P    16   1.00
                  1.445420D+04           4.000000D-06
                  3.421676D+03           4.000000D-05
                  1.111387D+03           2.290000D-04
                  4.251918D+02           1.019000D-03
                  1.802623D+02           3.602000D-03
                  8.206117D+01           1.055000D-02
                  3.929726D+01           2.370200D-02
                  1.941959D+01           3.998800D-02
                  9.828899D+00           4.043700D-02
                  5.016810D+00          -1.207400D-02
                  2.487091D+00          -1.189390D-01
                  1.198780D+00          -1.781000D-01
                  5.586950D-01          -1.238650D-01
                  2.089240D-01           4.297220D-01
                  8.460800D-02           6.507860D-01
                  3.325800D-02           6.417100D-02
            P    1   1.00
                  3.325800D-02           1.000000D+00
            P    1   1.00
                  1.307000D-02           1.000000D+00
            D    8   1.00
                  8.857680D+01           3.621000D-03
                  2.620450D+01           2.576600D-02
                  9.517470D+00           9.755600D-02
                  3.822480D+00           2.363120D-01
                  1.575120D+00           3.582860D-01
                  6.289280D-01           3.685430D-01
                  2.344240D-01           2.354940D-01
                  7.681500D-02           5.315600D-02
            D    8   1.00
                  8.857680D+01          -4.122000D-03
                  2.620450D+01          -2.930700D-02
                  9.517470D+00          -1.150620D-01
                  3.822480D+00          -2.730680D-01
                  1.575120D+00          -3.144230D-01
                  6.289280D-01           4.209700D-02
                  2.344240D-01           5.914030D-01
                  7.681500D-02           3.582150D-01
            D    1   1.00
                  7.681500D-02           1.000000D+00
            D    1   1.00
                  2.517000D-02           1.000000D+00
            F    2   1.00
                  2.221100D+00           4.235450D-01
                  5.231000D-01           7.741140D-01
            F    1   1.00
                  1.763600D-01           1.000000D+00
            ****
            -Mn     0
            S    20   1.00
                  3.960805D+06           8.242127D-06
                  5.931155D+05           6.408587D-05
                  1.349768D+05           3.369253D-04
                  3.823067D+04           1.420648D-03
                  1.247154D+04           5.143683D-03
                  4.501743D+03           1.648569D-02
                  1.755212D+03           4.698560D-02
                  7.273039D+02           1.162437D-01
                  3.163678D+02           2.335277D-01
                  1.430098D+02           3.292837D-01
                  6.621805D+01           2.440304D-01
                  2.991896D+01           7.219806D-02
                  1.430318D+01           7.687806D-02
                  6.839451D+00           7.852235D-02
                  3.012374D+00           1.294109D-02
                  1.418808D+00          -3.784873D-04
                  6.236240D-01          -2.503203D-05
                  1.340980D-01          -2.421517D-05
                  6.554800D-02           3.462071D-05
                  2.958400D-02           4.261482D-07
            S    20   1.00
                  3.960805D+06          -3.936095D-06
                  5.931155D+05          -3.060481D-05
                  1.349768D+05          -1.609626D-04
                  3.823067D+04          -6.792348D-04
                  1.247154D+04          -2.466182D-03
                  4.501743D+03          -7.957629D-03
                  1.755212D+03          -2.307248D-02
                  7.273039D+02          -5.932956D-02
                  3.163678D+02          -1.299451D-01
                  1.430098D+02          -2.212352D-01
                  6.621805D+01          -2.292550D-01
                  2.991896D+01           3.580733D-02
                  1.430318D+01           5.107602D-01
                  6.839451D+00           5.008307D-01
                  3.012374D+00           9.011830D-02
                  1.418808D+00          -6.909909D-03
                  6.236240D-01          -1.912925D-04
                  1.340980D-01          -6.032312D-04
                  6.554800D-02           5.621608D-04
                  2.958400D-02          -1.021109D-04
            S    20   1.00
                  3.960805D+06           9.462709D-07
                  5.931155D+05           7.360584D-06
                  1.349768D+05           3.869935D-05
                  3.823067D+04           1.635110D-04
                  1.247154D+04           5.941775D-04
                  4.501743D+03           1.927737D-03
                  1.755212D+03           5.641731D-03
                  7.273039D+02           1.487848D-02
                  3.163678D+02           3.414783D-02
                  1.430098D+02           6.405794D-02
                  6.621805D+01           7.557659D-02
                  2.991896D+01          -1.946070D-02
                  1.430318D+01          -2.957874D-01
                  6.839451D+00          -4.521170D-01
                  3.012374D+00           1.224531D-01
                  1.418808D+00           7.169756D-01
                  6.236240D-01           4.092712D-01
                  1.340980D-01           2.221969D-02
                  6.554800D-02          -9.011202D-03
                  2.958400D-02           3.691727D-03
            S    20   1.00
                  3.960805D+06          -2.095391D-07
                  5.931155D+05          -1.629439D-06
                  1.349768D+05          -8.570592D-06
                  3.823067D+04          -3.619272D-05
                  1.247154D+04          -1.316146D-04
                  4.501743D+03          -4.266810D-04
                  1.755212D+03          -1.250270D-03
                  7.273039D+02          -3.294665D-03
                  3.163678D+02          -7.581860D-03
                  1.430098D+02          -1.422864D-02
                  6.621805D+01          -1.693796D-02
                  2.991896D+01           4.454298D-03
                  1.430318D+01           6.867042D-02
                  6.839451D+00           1.113335D-01
                  3.012374D+00          -3.900820D-02
                  1.418808D+00          -2.215755D-01
                  6.236240D-01          -2.544359D-01
                  1.340980D-01           2.865866D-01
                  6.554800D-02           5.755741D-01
                  2.958400D-02           2.898778D-01
            S    20   1.00
                  3.960805D+06          -4.121231D-07
                  5.931155D+05          -3.282099D-06
                  1.349768D+05          -1.667433D-05
                  3.823067D+04          -7.369999D-05
                  1.247154D+04          -2.529495D-04
                  4.501743D+03          -8.801425D-04
                  1.755212D+03          -2.365482D-03
                  7.273039D+02          -6.926354D-03
                  3.163678D+02          -1.393851D-02
                  1.430098D+02          -3.143840D-02
                  6.621805D+01          -2.625749D-02
                  2.991896D+01          -1.048313D-02
                  1.430318D+01           1.856472D-01
                  6.839451D+00           1.524839D-01
                  3.012374D+00           7.411368D-02
                  1.418808D+00          -1.018097D+00
                  6.236240D-01           2.980372D-01
                  1.340980D-01           1.971989D+00
                  6.554800D-02          -1.179253D+00
                  2.958400D-02          -5.837703D-01
            S    1   1.00
                  2.958400D-02           1.000000D+00
            S    1   1.00
                  1.335000D-02           1.000000D+00
            P    16   1.00
                  1.620586D+04           4.200000D-05
                  3.836274D+03           3.730000D-04
                  1.246048D+03           2.149000D-03
                  4.767535D+02           9.445000D-03
                  2.021895D+02           3.329700D-02
                  9.209487D+01           9.475900D-02
                  4.414720D+01           2.081440D-01
                  2.185468D+01           3.318050D-01
                  1.108596D+01           3.331750D-01
                  5.674108D+00           1.576010D-01
                  2.823170D+00           2.144500D-02
                  1.368621D+00          -2.558000D-03
                  6.444310D-01          -2.027000D-03
                  2.483820D-01          -3.600000D-04
                  9.725500D-02           3.400000D-05
                  3.663300D-02          -1.300000D-05
            P    16   1.00
                  1.620586D+04          -1.500000D-05
                  3.836274D+03          -1.290000D-04
                  1.246048D+03          -7.480000D-04
                  4.767535D+02          -3.308000D-03
                  2.021895D+02          -1.181100D-02
                  9.209487D+01          -3.453300D-02
                  4.414720D+01          -7.878500D-02
                  2.185468D+01          -1.321830D-01
                  1.108596D+01          -1.371950D-01
                  5.674108D+00           2.707500D-02
                  2.823170D+00           3.288910D-01
                  1.368621D+00           4.572800D-01
                  6.444310D-01           2.889080D-01
                  2.483820D-01           4.743300D-02
                  9.725500D-02          -3.522000D-03
                  3.663300D-02           1.456000D-03
            P    16   1.00
                  1.620586D+04           3.000000D-06
                  3.836274D+03           3.000000D-05
                  1.246048D+03           1.720000D-04
                  4.767535D+02           7.620000D-04
                  2.021895D+02           2.726000D-03
                  9.209487D+01           7.976000D-03
                  4.414720D+01           1.828700D-02
                  2.185468D+01           3.077600D-02
                  1.108596D+01           3.237300D-02
                  5.674108D+00          -9.978000D-03
                  2.823170D+00          -9.052900D-02
                  1.368621D+00          -1.380040D-01
                  6.444310D-01          -7.796500D-02
                  2.483820D-01           2.295600D-01
                  9.725500D-02           5.761220D-01
                  3.663300D-02           3.485380D-01
            P    16   1.00
                  1.620586D+04           4.000000D-06
                  3.836274D+03           4.000000D-05
                  1.246048D+03           2.260000D-04
                  4.767535D+02           1.013000D-03
                  2.021895D+02           3.575000D-03
                  9.209487D+01           1.061200D-02
                  4.414720D+01           2.390200D-02
                  2.185468D+01           4.127900D-02
                  1.108596D+01           4.147500D-02
                  5.674108D+00          -9.458000D-03
                  2.823170D+00          -1.236950D-01
                  1.368621D+00          -1.743920D-01
                  6.444310D-01          -1.291700D-01
                  2.483820D-01           4.003480D-01
                  9.725500D-02           6.696460D-01
                  3.663300D-02           8.273200D-02
            P    1   1.00
                  3.663300D-02           1.000000D+00
            P    1   1.00
                  1.380000D-02           1.000000D+00
            D    8   1.00
                  1.006630D+02           3.579000D-03
                  2.983360D+01           2.582700D-02
                  1.088940D+01           9.855900D-02
                  4.393580D+00           2.383270D-01
                  1.817820D+00           3.587070D-01
                  7.278270D-01           3.650920D-01
                  2.712950D-01           2.337380D-01
                  8.830900D-02           5.661800D-02
            D    8   1.00
                  1.006630D+02          -3.454000D-03
                  2.983360D+01          -2.492500D-02
                  1.088940D+01          -9.763500D-02
                  4.393580D+00          -2.366920D-01
                  1.817820D+00          -2.923500D-01
                  7.278270D-01          -4.973000D-03
                  2.712950D-01           5.065880D-01
                  8.830900D-02           4.979510D-01
            D    1   1.00
                  8.830900D-02           1.000000D+00
            D    1   1.00
                  2.875000D-02           1.000000D+00
            F    2   1.00
                  2.703200D+00           4.267760D-01
                  6.438000D-01           7.697990D-01
            F    1   1.00
                  2.226000D-01           1.000000D+00
            ****
            -Fe     0
            S    20   1.00
                  4.316265D+06           8.048803D-06
                  6.463424D+05           6.258306D-05
                  1.470897D+05           3.290239D-04
                  4.166152D+04           1.387355D-03
                  1.359077D+04           5.023256D-03
                  4.905750D+03           1.610140D-02
                  1.912746D+03           4.590034D-02
                  7.926043D+02           1.136154D-01
                  3.448065D+02           2.283869D-01
                  1.558999D+02           3.221159D-01
                  7.223091D+01           2.383661D-01
                  3.272506D+01           7.404667D-02
                  1.566762D+01           9.214197D-02
                  7.503483D+00           9.339790D-02
                  3.312223D+00           1.573965D-02
                  1.558471D+00          -4.186682D-04
                  6.839140D-01           5.376318D-05
                  1.467570D-01          -3.816654D-05
                  7.058300D-02           4.319603D-05
                  3.144900D-02          -3.401019D-06
            S    20   1.00
                  4.316265D+06          -4.155954D-06
                  6.463424D+05          -3.231401D-05
                  1.470897D+05          -1.699525D-04
                  4.166152D+04          -7.171369D-04
                  1.359077D+04          -2.603625D-03
                  4.905750D+03          -8.399109D-03
                  1.912746D+03          -2.434109D-02
                  7.926043D+02          -6.251948D-02
                  3.448065D+02          -1.365929D-01
                  1.558999D+02          -2.312707D-01
                  7.223091D+01          -2.383734D-01
                  3.272506D+01           3.123837D-02
                  1.566762D+01           5.086818D-01
                  7.503483D+00           4.987695D-01
                  3.312223D+00           9.033552D-02
                  1.558471D+00          -6.005337D-03
                  6.839140D-01           2.312454D-04
                  1.467570D-01          -5.643680D-04
                  7.058300D-02           4.992260D-04
                  3.144900D-02          -1.015293D-04
            S    20   1.00
                  4.316265D+06           9.532178D-07
                  6.463424D+05           7.414605D-06
                  1.470897D+05           3.898393D-05
                  4.166152D+04           1.647152D-04
                  1.359077D+04           5.985980D-04
                  4.905750D+03           1.942390D-03
                  1.912746D+03           5.687237D-03
                  7.926043D+02           1.501329D-02
                  3.448065D+02           3.452455D-02
                  1.558999D+02           6.495820D-02
                  7.223091D+01           7.716194D-02
                  3.272506D+01          -1.873411D-02
                  1.566762D+01          -3.009185D-01
                  7.503483D+00          -4.554661D-01
                  3.312223D+00           1.286463D-01
                  1.558471D+00           7.183316D-01
                  6.839140D-01           4.051743D-01
                  1.467570D-01           2.168227D-02
                  7.058300D-02          -8.343566D-03
                  3.144900D-02           3.658979D-03
            S    20   1.00
                  4.316265D+06          -2.063008D-07
                  6.463424D+05          -1.604169D-06
                  1.470897D+05          -8.438437D-06
                  4.166152D+04          -3.563151D-05
                  1.359077D+04          -1.295998D-04
                  4.905750D+03          -4.201534D-04
                  1.912746D+03          -1.231954D-03
                  7.926043D+02          -3.248922D-03
                  3.448065D+02          -7.493717D-03
                  1.558999D+02          -1.410102D-02
                  7.223091D+01          -1.691600D-02
                  3.272506D+01           4.218996D-03
                  1.566762D+01           6.833810D-02
                  7.503483D+00           1.098201D-01
                  3.312223D+00          -4.009005D-02
                  1.558471D+00          -2.174739D-01
                  6.839140D-01          -2.465135D-01
                  1.467570D-01           2.731435D-01
                  7.058300D-02           5.748321D-01
                  3.144900D-02           3.012713D-01
            S    20   1.00
                  4.316265D+06          -4.009367D-07
                  6.463424D+05          -3.189255D-06
                  1.470897D+05          -1.623079D-05
                  4.166152D+04          -7.157920D-05
                  1.359077D+04          -2.463958D-04
                  4.905750D+03          -8.544907D-04
                  1.912746D+03          -2.307593D-03
                  7.926043D+02          -6.728292D-03
                  3.448065D+02          -1.366165D-02
                  1.558999D+02          -3.062240D-02
                  7.223091D+01          -2.631137D-02
                  3.272506D+01          -9.760183D-03
                  1.566762D+01           1.801906D-01
                  7.503483D+00           1.529634D-01
                  3.312223D+00           5.505413D-02
                  1.558471D+00          -9.551364D-01
                  6.839140D-01           2.586813D-01
                  1.467570D-01           1.834049D+00
                  7.058300D-02          -9.333240D-01
                  3.144900D-02          -6.981605D-01
            S    1   1.00
                  3.144900D-02           1.000000D+00
            S    1   1.00
                  1.401000D-02           1.000000D+00
            P    16   1.00
                  1.774569D+04           4.100000D-05
                  4.200721D+03           3.690000D-04
                  1.364429D+03           2.129000D-03
                  5.220806D+02           9.369000D-03
                  2.214595D+02           3.309700D-02
                  1.009096D+02           9.443100D-02
                  4.840115D+01           2.080770D-01
                  2.398536D+01           3.323330D-01
                  1.218250D+01           3.329870D-01
                  6.242298D+00           1.568430D-01
                  3.110944D+00           2.154900D-02
                  1.509958D+00          -2.095000D-03
                  7.108450D-01          -1.739000D-03
                  2.731900D-01          -3.000000D-04
                  1.042330D-01           2.900000D-05
                  3.829100D-02          -1.100000D-05
            P    16   1.00
                  1.774569D+04          -1.500000D-05
                  4.200721D+03          -1.300000D-04
                  1.364429D+03          -7.510000D-04
                  5.220806D+02          -3.329000D-03
                  2.214595D+02          -1.191200D-02
                  1.009096D+02          -3.493300D-02
                  4.840115D+01          -7.998900D-02
                  2.398536D+01          -1.346360D-01
                  1.218250D+01          -1.385980D-01
                  6.242298D+00           3.027800D-02
                  3.110944D+00           3.332160D-01
                  1.509958D+00           4.561530D-01
                  7.108450D-01           2.850510D-01
                  2.731900D-01           4.614400D-02
                  1.042330D-01          -3.249000D-03
                  3.829100D-02           1.357000D-03
            P    16   1.00
                  1.774569D+04           3.000000D-06
                  4.200721D+03           2.900000D-05
                  1.364429D+03           1.650000D-04
                  5.220806D+02           7.340000D-04
                  2.214595D+02           2.626000D-03
                  1.009096D+02           7.725000D-03
                  4.840115D+01           1.773300D-02
                  2.398536D+01           3.005500D-02
                  1.218250D+01           3.109400D-02
                  6.242298D+00          -1.004800D-02
                  3.110944D+00          -8.830600D-02
                  1.509958D+00          -1.298240D-01
                  7.108450D-01          -7.693700D-02
                  2.731900D-01           2.126610D-01
                  1.042330D-01           5.730610D-01
                  3.829100D-02           3.696510D-01
            P    16   1.00
                  1.774569D+04           5.000000D-06
                  4.200721D+03           4.200000D-05
                  1.364429D+03           2.410000D-04
                  5.220806D+02           1.085000D-03
                  2.214595D+02           3.831000D-03
                  1.009096D+02           1.142300D-02
                  4.840115D+01           2.579200D-02
                  2.398536D+01           4.481800D-02
                  1.218250D+01           4.459800D-02
                  6.242298D+00          -1.117700D-02
                  3.110944D+00          -1.381340D-01
                  1.509958D+00          -1.882850D-01
                  7.108450D-01          -1.073990D-01
                  2.731900D-01           4.448630D-01
                  1.042330D-01           6.402390D-01
                  3.829100D-02           6.445700D-02
            P    1   1.00
                  3.829100D-02           1.000000D+00
            P    1   1.00
                  1.407000D-02           1.000000D+00
            D    8   1.00
                  1.133440D+02           3.530000D-03
                  3.364140D+01           2.578400D-02
                  1.233100D+01           9.911900D-02
                  4.994780D+00           2.390730D-01
                  2.072800D+00           3.571990D-01
                  8.307530D-01           3.621880D-01
                  3.091780D-01           2.364610D-01
                  1.001300D-01           6.011800D-02
            D    8   1.00
                  1.133440D+02          -3.890000D-03
                  3.364140D+01          -2.844200D-02
                  1.233100D+01          -1.124290D-01
                  4.994780D+00          -2.742570D-01
                  2.072800D+00          -3.155460D-01
                  8.307530D-01           5.710900D-02
                  3.091780D-01           5.636040D-01
                  1.001300D-01           3.846370D-01
            D    1   1.00
                  1.001300D-01           1.000000D+00
            D    1   1.00
                  3.243000D-02           1.000000D+00
            F    2   1.00
                  3.224300D+00           4.222490D-01
                  7.758000D-01           7.714680D-01
            F    1   1.00
                  2.749000D-01           1.000000D+00
            ****
            -Co     0
            S    20   1.00
                  4.675675D+06           7.979026D-06
                  7.001615D+05           6.204071D-05
                  1.593373D+05           3.261735D-04
                  4.513046D+04           1.375360D-03
                  1.472238D+04           4.979997D-03
                  5.314222D+03           1.596434D-02
                  2.072018D+03           4.552086D-02
                  8.586188D+02           1.127385D-01
                  3.735497D+02           2.268262D-01
                  1.689229D+02           3.203074D-01
                  7.829639D+01           2.374021D-01
                  3.552123D+01           7.477686D-02
                  1.704144D+01           9.581872D-02
                  8.173000D+00           9.649911D-02
                  3.610318D+00           1.623362D-02
                  1.697047D+00          -4.535497D-04
                  7.435320D-01           5.113519D-05
                  1.583440D-01          -4.174508D-05
                  7.503600D-02           4.027577D-05
                  3.309100D-02          -5.789067D-06
            S    20   1.00
                  4.675675D+06          -4.200240D-06
                  7.001615D+05          -3.265831D-05
                  1.593373D+05          -1.717644D-04
                  4.513046D+04          -7.247853D-04
                  1.472238D+04          -2.631462D-03
                  5.314222D+03          -8.489272D-03
                  2.072018D+03          -2.460619D-02
                  8.586188D+02          -6.322059D-02
                  3.735497D+02          -1.381957D-01
                  1.689229D+02          -2.340680D-01
                  7.829639D+01          -2.415002D-01
                  3.552123D+01           3.035312D-02
                  1.704144D+01           5.101341D-01
                  8.173000D+00           4.974939D-01
                  3.610318D+00           8.970746D-02
                  1.697047D+00          -5.941034D-03
                  7.435320D-01           2.175362D-04
                  1.583440D-01          -5.480155D-04
                  7.503600D-02           4.525804D-04
                  3.309100D-02          -1.066748D-04
            S    20   1.00
                  4.675675D+06           9.592692D-07
                  7.001615D+05           7.461851D-06
                  1.593373D+05           3.923137D-05
                  4.513046D+04           1.657706D-04
                  1.472238D+04           6.024335D-04
                  5.314222D+03           1.955217D-03
                  2.072018D+03           5.726326D-03
                  8.586188D+02           1.512984D-02
                  3.735497D+02           3.483973D-02
                  1.689229D+02           6.570351D-02
                  7.829639D+01           7.831503D-02
                  3.552123D+01          -1.877037D-02
                  1.704144D+01          -3.062663D-01
                  8.173000D+00          -4.566429D-01
                  3.610318D+00           1.378169D-01
                  1.697047D+00           7.193676D-01
                  7.435320D-01           3.992579D-01
                  1.583440D-01           2.079933D-02
                  7.503600D-02          -7.820663D-03
                  3.309100D-02           3.533911D-03
            S    20   1.00
                  4.675675D+06          -2.028840D-07
                  7.001615D+05          -1.577580D-06
                  1.593373D+05          -8.298813D-06
                  4.513046D+04          -3.504154D-05
                  1.472238D+04          -1.274655D-04
                  5.314222D+03          -4.132695D-04
                  2.072018D+03          -1.212261D-03
                  8.586188D+02          -3.199318D-03
                  3.735497D+02          -7.390972D-03
                  1.689229D+02          -1.393649D-02
                  7.829639D+01          -1.678575D-02
                  3.552123D+01           4.149856D-03
                  1.704144D+01           6.797646D-02
                  8.173000D+00           1.075807D-01
                  3.610318D+00          -4.166022D-02
                  1.697047D+00          -2.128044D-01
                  7.435320D-01          -2.381360D-01
                  1.583440D-01           2.650788D-01
                  7.503600D-02           5.722774D-01
                  3.309100D-02           3.091556D-01
            S    20   1.00
                  4.675675D+06          -3.863053D-07
                  7.001615D+05          -3.068788D-06
                  1.593373D+05          -1.564826D-05
                  4.513046D+04          -6.883588D-05
                  1.472238D+04          -2.377367D-04
                  5.314222D+03          -8.213173D-04
                  2.072018D+03          -2.229630D-03
                  8.586188D+02          -6.467841D-03
                  3.735497D+02          -1.325463D-02
                  1.689229D+02          -2.946686D-02
                  7.829639D+01          -2.599066D-02
                  3.552123D+01          -8.499807D-03
                  1.704144D+01           1.727316D-01
                  8.173000D+00           1.512189D-01
                  3.610318D+00           3.554509D-02
                  1.697047D+00          -8.829353D-01
                  7.435320D-01           2.143530D-01
                  1.583440D-01           1.711865D+00
                  7.503600D-02          -7.140037D-01
                  3.309100D-02          -8.027727D-01
            S    1   1.00
                  3.309100D-02           1.000000D+00
            S    1   1.00
                  1.459000D-02           1.000000D+00
            P    16   1.00
                  1.926778D+04           4.100000D-05
                  4.560986D+03           3.690000D-04
                  1.481436D+03           2.128000D-03
                  5.668671D+02           9.372000D-03
                  2.404910D+02           3.315500D-02
                  1.096105D+02           9.475200D-02
                  5.259491D+01           2.090930D-01
                  2.608361D+01           3.337220D-01
                  1.326143D+01           3.322080D-01
                  6.799778D+00           1.546130D-01
                  3.393414D+00           2.090200D-02
                  1.648766D+00          -2.024000D-03
                  7.762820D-01          -1.697000D-03
                  2.980030D-01          -2.800000D-04
                  1.136180D-01           2.600000D-05
                  4.162400D-02          -1.000000D-05
            P    16   1.00
                  1.926778D+04          -1.500000D-05
                  4.560986D+03          -1.310000D-04
                  1.481436D+03          -7.580000D-04
                  5.668671D+02          -3.363000D-03
                  2.404910D+02          -1.205400D-02
                  1.096105D+02          -3.542400D-02
                  5.259491D+01          -8.128700D-02
                  2.608361D+01          -1.369080D-01
                  1.326143D+01          -1.390190D-01
                  6.799778D+00           3.546800D-02
                  3.393414D+00           3.384980D-01
                  1.648766D+00           4.544330D-01
                  7.762820D-01           2.797930D-01
                  2.980030D-01           4.477600D-02
                  1.136180D-01          -3.151000D-03
                  4.162400D-02           1.317000D-03
            P    16   1.00
                  1.926778D+04          -3.000000D-06
                  4.560986D+03          -2.900000D-05
                  1.481436D+03          -1.670000D-04
                  5.668671D+02          -7.420000D-04
                  2.404910D+02          -2.662000D-03
                  1.096105D+02          -7.841000D-03
                  5.259491D+01          -1.805100D-02
                  2.608361D+01          -3.058000D-02
                  1.326143D+01          -3.131200D-02
                  6.799778D+00           1.131100D-02
                  3.393414D+00           8.999000D-02
                  1.648766D+00           1.307330D-01
                  7.762820D-01           7.180800D-02
                  2.980030D-01          -2.216580D-01
                  1.136180D-01          -5.710250D-01
                  4.162400D-02          -3.637890D-01
            P    16   1.00
                  1.926778D+04           5.000000D-06
                  4.560986D+03           4.500000D-05
                  1.481436D+03           2.550000D-04
                  5.668671D+02           1.144000D-03
                  2.404910D+02           4.061000D-03
                  1.096105D+02           1.209500D-02
                  5.259491D+01           2.747600D-02
                  2.608361D+01           4.755700D-02
                  1.326143D+01           4.730200D-02
                  6.799778D+00          -1.441800D-02
                  3.393414D+00          -1.500620D-01
                  1.648766D+00          -1.990920D-01
                  7.762820D-01          -7.978300D-02
                  2.980030D-01           4.590350D-01
                  1.136180D-01           6.174950D-01
                  4.162400D-02           6.469000D-02
            P    1   1.00
                  4.162400D-02           1.000000D+00
            P    1   1.00
                  1.525000D-02           1.000000D+00
            D    8   1.00
                  1.262640D+02           3.510000D-03
                  3.752260D+01           2.588400D-02
                  1.380210D+01           1.000580D-01
                  5.609270D+00           2.405470D-01
                  2.333690D+00           3.568430D-01
                  9.364150D-01           3.595790D-01
                  3.482370D-01           2.366290D-01
                  1.123530D-01           6.212900D-02
            D    8   1.00
                  1.262640D+02          -4.067000D-03
                  3.752260D+01          -3.005300D-02
                  1.380210D+01          -1.196200D-01
                  5.609270D+00          -2.915130D-01
                  2.333690D+00          -3.180480D-01
                  9.364150D-01           9.169800D-02
                  3.482370D-01           5.608230D-01
                  1.123530D-01           3.586780D-01
            D    1   1.00
                  1.123530D-01           1.000000D+00
            D    1   1.00
                  3.625000D-02           1.000000D+00
            F    2   1.00
                  3.772400D+00           4.239660D-01
                  9.170000D-01           7.684290D-01
            F    1   1.00
                  3.271500D-01           1.000000D+00
            ****
            -Ni     0
            S    20   1.00
                  5.045991D+06           8.208996D-06
                  7.556142D+05           6.382884D-05
                  1.719568D+05           3.355800D-04
                  4.870479D+04           1.415075D-03
                  1.588841D+04           5.124444D-03
                  5.735123D+03           1.643256D-02
                  2.236137D+03           4.689398D-02
                  9.266468D+02           1.163534D-01
                  4.031743D+02           2.350511D-01
                  1.823476D+02           3.350184D-01
                  8.454885D+01           2.534779D-01
                  3.839634D+01           7.300901D-02
                  1.845859D+01           6.184244D-02
                  8.863548D+00           6.302956D-02
                  3.916227D+00           1.008063D-02
                  1.838870D+00          -2.244528D-04
                  8.043620D-01          -5.932767D-05
                  1.697970D-01          -1.158562D-05
                  7.930600D-02           8.115109D-06
                  3.467700D-02          -1.681699D-06
            S    20   1.00
                  5.045991D+06          -3.657849D-06
                  7.556142D+05          -2.844094D-05
                  1.719568D+05          -1.495928D-04
                  4.870479D+04          -6.313009D-04
                  1.588841D+04          -2.293052D-03
                  5.735123D+03          -7.405123D-03
                  2.236137D+03          -2.152032D-02
                  9.266468D+02          -5.560974D-02
                  4.031743D+02          -1.230176D-01
                  1.823476D+02          -2.130104D-01
                  8.454885D+01          -2.265837D-01
                  3.839634D+01           3.546796D-02
                  1.845859D+01           5.181697D-01
                  8.863548D+00           5.025630D-01
                  3.916227D+00           8.955674D-02
                  1.838870D+00          -7.031311D-03
                  8.043620D-01          -4.339167D-04
                  1.697970D-01          -5.831711D-04
                  7.930600D-02           4.228788D-04
                  3.467700D-02          -1.266714D-04
            S    20   1.00
                  5.045991D+06           9.594149D-07
                  7.556142D+05           7.462614D-06
                  1.719568D+05           3.923843D-05
                  4.870479D+04           1.657868D-04
                  1.588841D+04           6.025905D-04
                  5.735123D+03           1.955662D-03
                  2.236137D+03           5.730391D-03
                  9.266468D+02           1.514756D-02
                  4.031743D+02           3.493499D-02
                  1.823476D+02           6.598072D-02
                  8.454885D+01           7.893083D-02
                  3.839634D+01          -1.906249D-02
                  1.845859D+01          -3.095921D-01
                  8.863548D+00          -4.558610D-01
                  3.916227D+00           1.482931D-01
                  1.838870D+00           7.134039D-01
                  8.043620D-01           3.976063D-01
                  1.697970D-01           2.295523D-02
                  7.930600D-02          -9.151758D-03
                  3.467700D-02           3.875414D-03
            S    20   1.00
                  5.045991D+06          -2.013753D-07
                  7.556142D+05          -1.565832D-06
                  1.719568D+05          -8.237182D-06
                  4.870479D+04          -3.478105D-05
                  1.588841D+04          -1.265265D-04
                  5.735123D+03          -4.102589D-04
                  2.236137D+03          -1.203834D-03
                  9.266468D+02          -3.179062D-03
                  4.031743D+02          -7.353828D-03
                  1.823476D+02          -1.389022D-02
                  8.454885D+01          -1.677875D-02
                  3.839634D+01           4.163378D-03
                  1.845859D+01           6.814703D-02
                  8.863548D+00           1.061029D-01
                  3.916227D+00          -4.339980D-02
                  1.838870D+00          -2.094950D-01
                  8.043620D-01          -2.310271D-01
                  1.697970D-01           2.590532D-01
                  7.930600D-02           5.691426D-01
                  3.467700D-02           3.158125D-01
            S    20   1.00
                  5.045991D+06          -3.924245D-07
                  7.556142D+05          -3.113909D-06
                  1.719568D+05          -1.590447D-05
                  4.870479D+04          -6.981394D-05
                  1.588841D+04          -2.417848D-04
                  5.735123D+03          -8.326195D-04
                  2.236137D+03          -2.270294D-03
                  9.266468D+02          -6.557427D-03
                  4.031743D+02          -1.354288D-02
                  1.823476D+02          -2.989768D-02
                  8.454885D+01          -2.693106D-02
                  3.839634D+01          -7.827693D-03
                  1.845859D+01           1.741667D-01
                  8.863548D+00           1.595468D-01
                  3.916227D+00           1.995550D-02
                  1.838870D+00          -8.897000D-01
                  8.043620D-01           2.486892D-01
                  1.697970D-01           1.613012D+00
                  7.930600D-02          -5.990277D-01
                  3.467700D-02          -8.369078D-01
            S    1   1.00
                  3.467700D-02           1.000000D+00
            S    1   1.00
                  1.516000D-02           1.000000D+00
            P    16   1.00
                  2.102792D+04           4.100000D-05
                  4.977560D+03           3.630000D-04
                  1.616740D+03           2.097000D-03
                  6.186718D+02           9.250000D-03
                  2.625183D+02           3.279600D-02
                  1.196907D+02           9.400400D-02
                  5.746585D+01           2.082800D-01
                  2.852829D+01           3.336540D-01
                  1.452148D+01           3.329040D-01
                  7.453850D+00           1.553720D-01
                  3.723553D+00           2.085900D-02
                  1.809813D+00          -2.440000D-03
                  8.513360D-01          -1.998000D-03
                  3.248140D-01          -3.380000D-04
                  1.195220D-01           3.500000D-05
                  4.236600D-02          -1.200000D-05
            P    16   1.00
                  2.102792D+04          -1.500000D-05
                  4.977560D+03          -1.290000D-04
                  1.616740D+03          -7.490000D-04
                  6.186718D+02          -3.328000D-03
                  2.625183D+02          -1.194700D-02
                  1.196907D+02          -3.524200D-02
                  5.746585D+01          -8.120400D-02
                  2.852829D+01          -1.374930D-01
                  1.452148D+01          -1.392260D-01
                  7.453850D+00           3.601600D-02
                  3.723553D+00           3.391280D-01
                  1.809813D+00           4.504720D-01
                  8.513360D-01           2.817830D-01
                  3.248140D-01           4.789800D-02
                  1.195220D-01          -2.987000D-03
                  4.236600D-02           1.309000D-03
            P    16   1.00
                  2.102792D+04           3.000000D-06
                  4.977560D+03           2.600000D-05
                  1.616740D+03           1.520000D-04
                  6.186718D+02           6.780000D-04
                  2.625183D+02           2.427000D-03
                  1.196907D+02           7.201000D-03
                  5.746585D+01           1.657800D-02
                  2.852829D+01           2.839200D-02
                  1.452148D+01           2.859900D-02
                  7.453850D+00          -1.013200D-02
                  3.723553D+00          -8.291200D-02
                  1.809813D+00          -1.159980D-01
                  8.513360D-01          -7.279500D-02
                  3.248140D-01           1.956400D-01
                  1.195220D-01           5.670990D-01
                  4.236600D-02           3.952700D-01
            P    16   1.00
                  2.102792D+04           6.000000D-06
                  4.977560D+03           5.300000D-05
                  1.616740D+03           3.050000D-04
                  6.186718D+02           1.364000D-03
                  2.625183D+02           4.876000D-03
                  1.196907D+02           1.450300D-02
                  5.746585D+01           3.329600D-02
                  2.852829D+01           5.748200D-02
                  1.452148D+01           5.870200D-02
                  7.453850D+00          -1.990400D-02
                  3.723553D+00          -1.946950D-01
                  1.809813D+00          -2.396130D-01
                  8.513360D-01          -2.232000D-03
                  3.248140D-01           5.214350D-01
                  1.195220D-01           5.455400D-01
                  4.236600D-02           4.362200D-02
            P    1   1.00
                  4.236600D-02           1.000000D+00
            P    1   1.00
                  1.502000D-02           1.000000D+00
            D    8   1.00
                  1.402527D+02           3.376000D-03
                  4.172610D+01           2.514100D-02
                  1.539810D+01           9.774600D-02
                  6.277100D+00           2.347090D-01
                  2.618500D+00           3.469450D-01
                  1.052600D+00           3.510680D-01
                  3.916000D-01           2.502550D-01
                  1.262000D-01           1.000820D-01
            D    8   1.00
                  1.402527D+02          -3.495000D-03
                  4.172610D+01          -2.601500D-02
                  1.539810D+01          -1.038760D-01
                  6.277100D+00          -2.520700D-01
                  2.618500D+00          -2.945800D-01
                  1.052600D+00           1.152000D-03
                  3.916000D-01           4.385890D-01
                  1.262000D-01           5.436260D-01
            D    1   1.00
                  1.262000D-01           1.000000D+00
            D    1   1.00
                  4.067000D-02           1.000000D+00
            F    2   1.00
                  4.345500D+00           4.174290D-01
                  1.068000D+00           7.714830D-01
            F    1   1.00
                  4.083000D-01           1.000000D+00
            ****
            -Cu     0
            S    20   1.00
                  5.430321D+06           7.801026D-06
                  8.131665D+05           6.065666D-05
                  1.850544D+05           3.188964D-04
                  5.241466D+04           1.344687D-03
                  1.709868D+04           4.869050D-03
                  6.171994D+03           1.561013D-02
                  2.406481D+03           4.452077D-02
                  9.972584D+02           1.103111D-01
                  4.339289D+02           2.220342D-01
                  1.962869D+02           3.133739D-01
                  9.104280D+01           2.315121D-01
                  4.138425D+01           7.640920D-02
                  1.993278D+01           1.103818D-01
                  9.581891D+00           1.094372D-01
                  4.234516D+00           1.836311D-02
                  1.985814D+00          -6.043084D-04
                  8.670830D-01           5.092245D-05
                  1.813390D-01          -5.540730D-05
                  8.365700D-02           3.969482D-05
                  3.626700D-02          -1.269538D-05
            S    20   1.00
                  5.430321D+06          -4.404706D-06
                  8.131665D+05          -3.424801D-05
                  1.850544D+05          -1.801238D-04
                  5.241466D+04          -7.600455D-04
                  1.709868D+04          -2.759348D-03
                  6.171994D+03          -8.900970D-03
                  2.406481D+03          -2.579378D-02
                  9.972584D+02          -6.623861D-02
                  4.339289D+02          -1.445927D-01
                  1.962869D+02          -2.440110D-01
                  9.104280D+01          -2.504837D-01
                  4.138425D+01           2.852577D-02
                  1.993278D+01           5.115874D-01
                  9.581891D+00           4.928061D-01
                  4.234516D+00           8.788437D-02
                  1.985814D+00          -5.820281D-03
                  8.670830D-01           2.013508D-04
                  1.813390D-01          -5.182553D-04
                  8.365700D-02           3.731503D-04
                  3.626700D-02          -1.193171D-04
            S    20   1.00
                  5.430321D+06           9.704682D-07
                  8.131665D+05           7.549245D-06
                  1.850544D+05           3.968892D-05
                  5.241466D+04           1.677200D-04
                  1.709868D+04           6.095101D-04
                  6.171994D+03           1.978846D-03
                  2.406481D+03           5.798049D-03
                  9.972584D+02           1.534158D-02
                  4.339289D+02           3.540484D-02
                  1.962869D+02           6.702098D-02
                  9.104280D+01           8.026945D-02
                  4.138425D+01          -1.927231D-02
                  1.993278D+01          -3.160129D-01
                  9.581891D+00          -4.573162D-01
                  4.234516D+00           1.550841D-01
                  1.985814D+00           7.202872D-01
                  8.670830D-01           3.885122D-01
                  1.813390D-01           1.924326D-02
                  8.365700D-02          -7.103807D-03
                  3.626700D-02           3.272906D-03
            S    20   1.00
                  5.430321D+06          -1.959354D-07
                  8.131665D+05          -1.523472D-06
                  1.850544D+05          -8.014808D-06
                  5.241466D+04          -3.383992D-05
                  1.709868D+04          -1.231191D-04
                  6.171994D+03          -3.992085D-04
                  2.406481D+03          -1.171900D-03
                  9.972584D+02          -3.096141D-03
                  4.339289D+02          -7.171993D-03
                  1.962869D+02          -1.356621D-02
                  9.104280D+01          -1.643989D-02
                  4.138425D+01           4.107628D-03
                  1.993278D+01           6.693964D-02
                  9.581891D+00           1.028221D-01
                  4.234516D+00          -4.422945D-02
                  1.985814D+00          -2.031191D-01
                  8.670830D-01          -2.230022D-01
                  1.813390D-01           2.517975D-01
                  8.365700D-02           5.650091D-01
                  3.626700D-02           3.247243D-01
            S    20   1.00
                  5.430321D+06          -3.532229D-07
                  8.131665D+05          -2.798812D-06
                  1.850544D+05          -1.432517D-05
                  5.241466D+04          -6.270946D-05
                  1.709868D+04          -2.179490D-04
                  6.171994D+03          -7.474316D-04
                  2.406481D+03          -2.049271D-03
                  9.972584D+02          -5.885203D-03
                  4.339289D+02          -1.226885D-02
                  1.962869D+02          -2.683147D-02
                  9.104280D+01          -2.479261D-02
                  4.138425D+01          -5.984746D-03
                  1.993278D+01           1.557124D-01
                  9.581891D+00           1.436683D-01
                  4.234516D+00           8.374103D-03
                  1.985814D+00          -7.460711D-01
                  8.670830D-01           1.244367D-01
                  1.813390D-01           1.510110D+00
                  8.365700D-02          -3.477122D-01
                  3.626700D-02          -9.774169D-01
            S    1   1.00
                  3.626700D-02           1.000000D+00
            S    1   1.00
                  1.572000D-02           1.000000D+00
            P    16   1.00
                  2.276057D+04           4.000000D-05
                  5.387679D+03           3.610000D-04
                  1.749945D+03           2.083000D-03
                  6.696653D+02           9.197000D-03
                  2.841948D+02           3.266000D-02
                  1.296077D+02           9.379500D-02
                  6.225415D+01           2.082740D-01
                  3.092964D+01           3.339930D-01
                  1.575827D+01           3.324930D-01
                  8.094211D+00           1.547280D-01
                  4.046921D+00           2.127100D-02
                  1.967869D+00          -1.690000D-03
                  9.252950D-01          -1.516000D-03
                  3.529920D-01          -2.420000D-04
                  1.273070D-01           2.300000D-05
                  4.435600D-02          -9.000000D-06
            P    16   1.00
                  2.276057D+04          -1.500000D-05
                  5.387679D+03          -1.310000D-04
                  1.749945D+03          -7.550000D-04
                  6.696653D+02          -3.359000D-03
                  2.841948D+02          -1.208100D-02
                  1.296077D+02          -3.570300D-02
                  6.225415D+01          -8.250200D-02
                  3.092964D+01          -1.398900D-01
                  1.575827D+01          -1.407290D-01
                  8.094211D+00           3.876600D-02
                  4.046921D+00           3.426950D-01
                  1.967869D+00           4.523100D-01
                  9.252950D-01           2.770540D-01
                  3.529920D-01           4.388500D-02
                  1.273070D-01          -2.802000D-03
                  4.435600D-02           1.152000D-03
            P    16   1.00
                  2.276057D+04           3.000000D-06
                  5.387679D+03           2.500000D-05
                  1.749945D+03           1.470000D-04
                  6.696653D+02           6.560000D-04
                  2.841948D+02           2.351000D-03
                  1.296077D+02           7.004000D-03
                  6.225415D+01           1.613100D-02
                  3.092964D+01           2.777000D-02
                  1.575827D+01           2.756700D-02
                  8.094211D+00          -1.011500D-02
                  4.046921D+00          -8.100900D-02
                  1.967869D+00          -1.104090D-01
                  9.252950D-01          -7.173200D-02
                  3.529920D-01           1.879300D-01
                  1.273070D-01           5.646290D-01
                  4.435600D-02           4.070000D-01
            P    16   1.00
                  2.276057D+04           5.000000D-06
                  5.387679D+03           4.900000D-05
                  1.749945D+03           2.780000D-04
                  6.696653D+02           1.253000D-03
                  2.841948D+02           4.447000D-03
                  1.296077D+02           1.337000D-02
                  6.225415D+01           3.046900D-02
                  3.092964D+01           5.344700D-02
                  1.575827D+01           5.263900D-02
                  8.094211D+00          -1.688100D-02
                  4.046921D+00          -1.794480D-01
                  1.967869D+00          -2.095880D-01
                  9.252950D-01          -3.963300D-02
                  3.529920D-01           5.021300D-01
                  1.273070D-01           5.811110D-01
                  4.435600D-02           4.566600D-02
            P    1   1.00
                  4.435600D-02           1.000000D+00
            P    1   1.00
                  1.545000D-02           1.000000D+00
            D    8   1.00
                  1.738970D+02           2.700000D-03
                  5.188690D+01           2.090900D-02
                  1.934190D+01           8.440800D-02
                  7.975720D+00           2.139990D-01
                  3.398230D+00           3.359800D-01
                  1.409320D+00           3.573010D-01
                  5.488580D-01           2.645780D-01
                  1.901990D-01           1.039720D-01
            D    8   1.00
                  1.738970D+02          -3.363000D-03
                  5.188690D+01          -2.607900D-02
                  1.934190D+01          -1.082310D-01
                  7.975720D+00          -2.822170D-01
                  3.398230D+00          -3.471900D-01
                  1.409320D+00           2.671100D-02
                  5.488580D-01           4.920470D-01
                  1.901990D-01           4.384220D-01
            D    1   1.00
                  1.901990D-01           1.000000D+00
            D    1   1.00
                  6.591000D-02           1.000000D+00
            F    2   1.00
                  5.028600D+00           4.242800D-01
                  1.259400D+00           7.630250D-01
            F    1   1.00
                  4.617200D-01           1.000000D+00
            ****
            -Zn     0
            S    20   1.00
                  5.820021D+06           8.549241D-06
                  8.715234D+05           6.647410D-05
                  1.983350D+05           3.494962D-04
                  5.617631D+04           1.473832D-03
                  1.832582D+04           5.338330D-03
                  6.614955D+03           1.712708D-02
                  2.579199D+03           4.894085D-02
                  1.068849D+03           1.217934D-01
                  4.651045D+02           2.476589D-01
                  2.104130D+02           3.582431D-01
                  9.761629D+01           2.798174D-01
                  4.438020D+01           6.857491D-02
                  2.142308D+01          -1.311092D-03
                  1.030891D+01           1.914001D-03
                  4.553645D+00          -8.759220D-04
                  2.132821D+00           3.740096D-04
                  9.296970D-01          -1.401399D-04
                  1.921470D-01           4.757132D-05
                  8.759500D-02          -3.642711D-05
                  3.770200D-02           1.153248D-05
            S    20   1.00
                  5.820021D+06          -2.640069D-06
                  8.715234D+05          -2.052720D-05
                  1.983350D+05          -1.079859D-04
                  5.617631D+04          -4.558577D-04
                  1.832582D+04          -1.657758D-03
                  6.614955D+03          -5.368492D-03
                  2.579199D+03          -1.571249D-02
                  1.068849D+03          -4.122558D-02
                  4.651045D+02          -9.406459D-02
                  2.104130D+02          -1.719954D-01
                  9.761629D+01          -1.958523D-01
                  4.438020D+01           4.532907D-02
                  2.142308D+01           5.244442D-01
                  1.030891D+01           5.006142D-01
                  4.553645D+00           8.945527D-02
                  2.132821D+00          -2.146262D-03
                  9.296970D-01           2.112113D-03
                  1.921470D-01          -4.133980D-04
                  8.759500D-02           3.209752D-04
                  3.770200D-02          -1.016140D-04
            S    20   1.00
                  5.820021D+06           9.967103D-07
                  8.715234D+05           7.754163D-06
                  1.983350D+05           4.076019D-05
                  5.617631D+04           1.722811D-04
                  1.832582D+04           6.259370D-04
                  6.614955D+03           2.032855D-03
                  2.579199D+03           5.954646D-03
                  1.068849D+03           1.576640D-02
                  4.651045D+02           3.637638D-02
                  2.104130D+02           6.892343D-02
                  9.761629D+01           8.238093D-02
                  4.438020D+01          -2.011360D-02
                  2.142308D+01          -3.252526D-01
                  1.030891D+01          -4.602899D-01
                  4.553645D+00           1.635546D-01
                  2.132821D+00           7.297118D-01
                  9.296970D-01           3.769751D-01
                  1.921470D-01           1.433224D-02
                  8.759500D-02          -6.671210D-03
                  3.770200D-02           1.766214D-03
            S    20   1.00
                  5.820021D+06           1.995818D-07
                  8.715234D+05           1.552973D-06
                  1.983350D+05           8.161259D-06
                  5.617631D+04           3.450747D-05
                  1.832582D+04           1.253275D-04
                  6.614955D+03           4.072990D-04
                  2.579199D+03           1.192734D-03
                  1.068849D+03           3.163140D-03
                  4.651045D+02           7.303942D-03
                  2.104130D+02           1.391279D-02
                  9.761629D+01           1.670620D-02
                  4.438020D+01          -4.035586D-03
                  2.142308D+01          -6.968861D-02
                  1.030891D+01          -1.030105D-01
                  4.553645D+00           4.471442D-02
                  2.132821D+00           2.150027D-01
                  9.296970D-01           2.220163D-01
                  1.921470D-01          -3.114776D-01
                  8.759500D-02          -5.693429D-01
                  3.770200D-02          -2.678440D-01
            S    20   1.00
                  5.820021D+06          -5.435910D-07
                  8.715234D+05          -4.336894D-06
                  1.983350D+05          -2.197572D-05
                  5.617631D+04          -9.747392D-05
                  1.832582D+04          -3.331615D-04
                  6.614955D+03          -1.166192D-03
                  2.579199D+03          -3.119308D-03
                  1.068849D+03          -9.239504D-03
                  4.651045D+02          -1.855471D-02
                  2.104130D+02          -4.281189D-02
                  9.761629D+01          -3.571095D-02
                  4.438020D+01          -1.638350D-02
                  2.142308D+01           2.644664D-01
                  1.030891D+01           2.086588D-01
                  4.553645D+00          -1.774382D-02
                  2.132821D+00          -1.353873D+00
                  9.296970D-01           8.182926D-01
                  1.921470D-01           1.695036D+00
                  8.759500D-02          -1.388656D+00
                  3.770200D-02          -2.188900D-01
            S    1   1.00
                  3.770200D-02           1.000000D+00
            S    1   1.00
                  1.623000D-02           1.000000D+00
            P    16   1.00
                  2.441198D+04          -1.500000D-05
                  5.778518D+03          -1.350000D-04
                  1.876862D+03          -7.820000D-04
                  7.182361D+02          -3.478000D-03
                  3.048327D+02          -1.252000D-02
                  1.390453D+02          -3.701600D-02
                  6.680417D+01          -8.555900D-02
                  3.320699D+01          -1.447180D-01
                  1.692816D+01          -1.434420D-01
                  8.696229D+00           4.359500D-02
                  4.350510D+00           3.488880D-01
                  2.116523D+00           4.538650D-01
                  9.953870D-01           2.685940D-01
                  3.781120D-01           3.886800D-02
                  1.345790D-01          -2.492000D-03
                  4.628200D-02           1.014000D-03
            P    16   1.00
                  2.441198D+04           3.000000D-06
                  5.778518D+03           2.500000D-05
                  1.876862D+03           1.440000D-04
                  7.182361D+02           6.450000D-04
                  3.048327D+02           2.311000D-03
                  1.390453D+02           6.898000D-03
                  6.680417D+01           1.588200D-02
                  3.320699D+01           2.735000D-02
                  1.692816D+01           2.662100D-02
                  8.696229D+00          -1.085800D-02
                  4.350510D+00          -7.985300D-02
                  2.116523D+00          -1.061270D-01
                  9.953870D-01          -6.888300D-02
                  3.781120D-01           1.843850D-01
                  1.345790D-01           5.617880D-01
                  4.628200D-02           4.144160D-01
            P    16   1.00
                  2.441198D+04           5.000000D-06
                  5.778518D+03           4.200000D-05
                  1.876862D+03           2.380000D-04
                  7.182361D+02           1.088000D-03
                  3.048327D+02           3.821000D-03
                  1.390453D+02           1.164400D-02
                  6.680417D+01           2.616700D-02
                  3.320699D+01           4.675000D-02
                  1.692816D+01           4.330900D-02
                  8.696229D+00          -1.342900D-02
                  4.350510D+00          -1.538970D-01
                  2.116523D+00          -1.674130D-01
                  9.953870D-01          -8.499500D-02
                  3.781120D-01           4.508130D-01
                  1.345790D-01           6.408690D-01
                  4.628200D-02           5.417200D-02
            P    15   1.00
                  2.441198D+04           4.100000D-05
                  5.778518D+03           3.610000D-04
                  1.876862D+03           2.088000D-03
                  7.182361D+02           9.221000D-03
                  3.048327D+02           3.277300D-02
                  1.390453D+02           9.417900D-02
                  6.680417D+01           2.091320D-01
                  3.320699D+01           3.345690D-01
                  1.692816D+01           3.303590D-01
                  8.696229D+00           1.523470D-01
                  4.350510D+00           2.298400D-02
                  2.116523D+00           1.607000D-03
                  9.953870D-01           4.680000D-04
                  3.781120D-01           6.600000D-05
                  1.345790D-01          -2.000000D-06
            P    1   1.00
                  4.628200D-02           1.000000D+00
            P    1   1.00
                  1.592000D-02           1.000000D+00
            D    8   1.00
                  2.056177D+02           2.342000D-03
                  6.144981D+01           1.860600D-02
                  2.305689D+01           7.710200D-02
                  9.577739D+00           2.020260D-01
                  4.133734D+00           3.294540D-01
                  1.747518D+00           3.609760D-01
                  6.995600D-01           2.716570D-01
                  2.516080D-01           1.049810D-01
            D    8   1.00
                  2.056177D+02           3.279000D-03
                  6.144981D+01           2.617600D-02
                  2.305689D+01           1.113670D-01
                  9.577739D+00           3.045810D-01
                  4.133734D+00           3.862990D-01
                  1.747518D+00          -5.837500D-02
                  6.995600D-01          -5.388760D-01
                  2.516080D-01          -3.454730D-01
            D    1   1.00
                  2.516080D-01           1.000000D+00
            D    1   1.00
                  9.049000D-02           1.000000D+00
            F    2   1.00
                  5.734400D+00           4.311320D-01
                  1.461500D+00           7.546420D-01
            F    1   1.00
                  5.486100D-01           1.000000D+00
            ****
            -Ga     0
            S    14   1.00
                  4.851300D+05           2.068000D-04
                  7.271900D+04           1.604700D-03
                  1.655200D+04           8.340200D-03
                  4.687800D+03           3.402480D-02
                  1.529100D+03           1.111699D-01
                  5.518100D+02           2.753930D-01
                  2.151800D+02           4.212628D-01
                  8.817400D+01           2.738906D-01
                  2.715400D+01           2.837200D-02
                  1.150300D+01          -6.293100D-03
                  3.301800D+00           2.060600D-03
                  1.331400D+00          -9.269000D-04
                  1.931600D-01           2.273000D-04
                  7.089500D-02          -1.063000D-04
            S    14   1.00
                  4.851300D+05          -6.430000D-05
                  7.271900D+04          -4.954000D-04
                  1.655200D+04          -2.620800D-03
                  4.687800D+03          -1.068390D-02
                  1.529100D+03          -3.741230D-02
                  5.518100D+02          -1.009636D-01
                  2.151800D+02          -2.145141D-01
                  8.817400D+01          -1.752297D-01
                  2.715400D+01           4.831599D-01
                  1.150300D+01           6.323677D-01
                  3.301800D+00           6.849420D-02
                  1.331400D+00          -1.187120D-02
                  1.931600D-01           2.665200D-03
                  7.089500D-02          -1.225100D-03
            S    14   1.00
                  4.851300D+05           2.450000D-05
                  7.271900D+04           1.895000D-04
                  1.655200D+04           9.964000D-04
                  4.687800D+03           4.108200D-03
                  1.529100D+03           1.429380D-02
                  5.518100D+02           3.980340D-02
                  2.151800D+02           8.559400D-02
                  8.817400D+01           7.963050D-02
                  2.715400D+01          -2.939107D-01
                  1.150300D+01          -5.263914D-01
                  3.301800D+00           5.864249D-01
                  1.331400D+00           6.726347D-01
                  1.931600D-01           2.761230D-02
                  7.089500D-02          -9.365100D-03
            S    14   1.00
                  4.851300D+05          -5.700000D-06
                  7.271900D+04          -4.400000D-05
                  1.655200D+04          -2.305000D-04
                  4.687800D+03          -9.544000D-04
                  1.529100D+03          -3.305500D-03
                  5.518100D+02          -9.288800D-03
                  2.151800D+02          -1.986440D-02
                  8.817400D+01          -1.908880D-02
                  2.715400D+01           7.323560D-02
                  1.150300D+01           1.341526D-01
                  3.301800D+00          -1.831929D-01
                  1.331400D+00          -3.571308D-01
                  1.931600D-01           6.246013D-01
                  7.089500D-02           5.238430D-01
            S    1   1.00
                  7.089500D-02           1.000000D+00
            S    1   1.00
                  0.0243480              1.0000000
            P    11   1.00
                  3.248600D+03           1.526000D-03
                  7.699700D+02           1.274860D-02
                  2.482000D+02           6.337420D-02
                  9.336400D+01           2.065775D-01
                  3.825100D+01           4.092963D-01
                  1.642200D+01           3.919183D-01
                  6.791800D+00           1.029441D-01
                  2.833600D+00          -7.203000D-04
                  1.106200D+00           2.095000D-03
                  2.225000D-01          -3.290000D-04
                  6.177200D-02           1.162000D-04
            P    11   1.00
                  3.248600D+03          -5.803000D-04
                  7.699700D+02          -4.864700D-03
                  2.482000D+02          -2.483940D-02
                  9.336400D+01          -8.417590D-02
                  3.825100D+01          -1.800885D-01
                  1.642200D+01          -1.585555D-01
                  6.791800D+00           2.355376D-01
                  2.833600D+00           5.820587D-01
                  1.106200D+00           3.366619D-01
                  2.225000D-01           1.719120D-02
                  6.177200D-02          -3.326500D-03
            P    11   1.00
                  3.248600D+03           9.500000D-05
                  7.699700D+02           7.832000D-04
                  2.482000D+02           4.085500D-03
                  9.336400D+01           1.359870D-02
                  3.825100D+01           3.026950D-02
                  1.642200D+01           2.417900D-02
                  6.791800D+00          -4.237770D-02
                  2.833600D+00          -1.265661D-01
                  1.106200D+00          -4.994440D-02
                  2.225000D-01           4.494199D-01
                  6.177200D-02           6.718899D-01
            P    1   1.00
                  6.177200D-02           1.000000D+00
            P    1   1.00
                  0.0151640              1.0000000
            D    5   1.00
                  6.533700D+01           2.738250D-02
                  1.849700D+01           1.510805D-01
                  6.315000D+00           3.749217D-01
                  2.163500D+00           4.750799D-01
                  6.667500D-01           2.982750D-01
            D    1   1.00
                  1.884000D-01           1.000000D+00
            D    1   1.00
                  0.0537000              1.0000000
            ****
            -Ge     0
            S    14   1.00
                  5.218000D+05           2.045000D-04
                  7.821400D+04           1.586800D-03
                  1.780300D+04           8.248000D-03
                  5.041900D+03           3.366490D-02
                  1.644500D+03           1.101249D-01
                  5.934300D+02           2.735607D-01
                  2.313600D+02           4.210670D-01
                  9.476200D+01           2.766791D-01
                  2.927400D+01           2.921800D-02
                  1.245000D+01          -6.590300D-03
                  3.646300D+00           2.243000D-03
                  1.502500D+00          -1.038200D-03
                  2.450300D-01           2.695000D-04
                  9.159400D-02          -1.228000D-04
            S    14   1.00
                  5.218000D+05          -6.380000D-05
                  7.821400D+04          -4.916000D-04
                  1.780300D+04          -2.600200D-03
                  5.041900D+03          -1.060800D-02
                  1.644500D+03          -3.716020D-02
                  5.934300D+02          -1.005790D-01
                  2.313600D+02          -2.143977D-01
                  9.476200D+01          -1.782617D-01
                  2.927400D+01           4.777404D-01
                  1.245000D+01           6.355983D-01
                  3.646300D+00           7.221740D-02
                  1.502500D+00          -1.272650D-02
                  2.450300D-01           2.960800D-03
                  9.159400D-02          -1.329200D-03
            S    14   1.00
                  5.218000D+05           2.460000D-05
                  7.821400D+04           1.900000D-04
                  1.780300D+04           9.993000D-04
                  5.041900D+03           4.120000D-03
                  1.644500D+03           1.435570D-02
                  5.934300D+02           4.003750D-02
                  2.313600D+02           8.657940D-02
                  9.476200D+01           8.158610D-02
                  2.927400D+01          -2.934770D-01
                  1.245000D+01          -5.367983D-01
                  3.646300D+00           5.637985D-01
                  1.502500D+00           6.947182D-01
                  2.450300D-01           3.157300D-02
                  9.159400D-02          -9.894900D-03
            S    14   1.00
                  5.218000D+05          -6.300000D-06
                  7.821400D+04          -4.860000D-05
                  1.780300D+04          -2.553000D-04
                  5.041900D+03          -1.056000D-03
                  1.644500D+03          -3.667400D-03
                  5.934300D+02          -1.030530D-02
                  2.313600D+02          -2.222000D-02
                  9.476200D+01          -2.152750D-02
                  2.927400D+01           8.067520D-02
                  1.245000D+01           1.524958D-01
                  3.646300D+00          -1.980528D-01
                  1.502500D+00          -4.073954D-01
                  2.450300D-01           6.477288D-01
                  9.159400D-02           5.222033D-01
            S    1   1.00
                  9.159400D-02           1.000000D+00
            S    1   1.00
                  0.0339610              1.0000000
            P    11   1.00
                  3.568100D+03           1.459100D-03
                  8.457200D+02           1.221760D-02
                  2.727400D+02           6.104900D-02
                  1.026800D+02           2.008039D-01
                  4.214800D+01           4.038942D-01
                  1.814900D+01           3.970027D-01
                  7.593400D+00           1.105481D-01
                  3.196400D+00           7.680000D-05
                  1.274300D+00           2.126300D-03
                  2.825800D-01          -3.744000D-04
                  8.409000D-02           1.321000D-04
            P    11   1.00
                  3.568100D+03          -5.630000D-04
                  8.457200D+02          -4.735400D-03
                  2.727400D+02          -2.426430D-02
                  1.026800D+02          -8.309000D-02
                  4.214800D+01          -1.800247D-01
                  1.814900D+01          -1.663295D-01
                  7.593400D+00           2.193717D-01
                  3.196400D+00           5.820239D-01
                  1.274300D+00           3.477720D-01
                  2.825800D-01           1.924550D-02
                  8.409000D-02          -3.482500D-03
            P    11   1.00
                  3.568100D+03           1.115000D-04
                  8.457200D+02           9.212000D-04
                  2.727400D+02           4.827300D-03
                  1.026800D+02           1.622720D-02
                  4.214800D+01           3.663540D-02
                  1.814900D+01           3.078670D-02
                  7.593400D+00          -4.806430D-02
                  3.196400D+00          -1.559804D-01
                  1.274300D+00          -6.323700D-02
                  2.825800D-01           5.040819D-01
                  8.409000D-02           6.182200D-01
            P    1   1.00
                  8.409000D-02           1.000000D+00
            P    1   1.00
                  0.0239450              1.0000000
            D    5   1.00
                  7.476200D+01           2.576840D-02
                  2.130200D+01           1.454421D-01
                  7.343600D+00           3.713721D-01
                  2.565100D+00           4.800002D-01
                  8.197000D-01           2.896800D-01
            D    1   1.00
                  2.470000D-01           1.000000D+00
            D    1   1.00
                  0.0771000              1.0000000
            ****
            -As     0
            S    14   1.00
                  5.595838D+05           2.024000D-04
                  8.387933D+04           1.570900D-03
                  1.909267D+04           8.166200D-03
                  5.407392D+03           3.333990D-02
                  1.763756D+03           1.091726D-01
                  6.364567D+02           2.718853D-01
                  2.480884D+02           4.208509D-01
                  1.015785D+02           2.792257D-01
                  3.147551D+01           3.003010D-02
                  1.343728D+01          -6.880400D-03
                  4.008690D+00           2.424000D-03
                  1.684929D+00          -1.149100D-03
                  3.000190D-01           3.095000D-04
                  1.135870D-01          -1.377000D-04
            S    14   1.00
                  5.595838D+05          -6.340000D-05
                  8.387933D+04          -4.883000D-04
                  1.909267D+04          -2.582100D-03
                  5.407392D+03          -1.054020D-02
                  1.763756D+03          -3.693250D-02
                  6.364567D+02          -1.002355D-01
                  2.480884D+02          -2.142948D-01
                  1.015785D+02          -1.810526D-01
                  3.147551D+01           4.725410D-01
                  1.343728D+01           6.386194D-01
                  4.008690D+00           7.581070D-02
                  1.684929D+00          -1.352780D-02
                  3.000190D-01           3.197000D-03
                  1.135870D-01          -1.405600D-03
            S    14   1.00
                  5.595838D+05           2.460000D-05
                  8.387933D+04           1.907000D-04
                  1.909267D+04           1.003100D-03
                  5.407392D+03           4.135300D-03
                  1.763756D+03           1.442590D-02
                  6.364567D+02           4.029620D-02
                  2.480884D+02           8.756700D-02
                  1.015785D+02           8.351780D-02
                  3.147551D+01          -2.932935D-01
                  1.343728D+01          -5.470520D-01
                  4.008690D+00           5.438738D-01
                  1.684929D+00           7.143591D-01
                  3.000190D-01           3.534430D-02
                  1.135870D-01          -1.028920D-02
            S    14   1.00
                  5.595838D+05          -6.800000D-06
                  8.387933D+04          -5.250000D-05
                  1.909267D+04          -2.756000D-04
                  5.407392D+03          -1.138900D-03
                  1.763756D+03          -3.964600D-03
                  6.364567D+02          -1.114230D-02
                  2.480884D+02          -2.419910D-02
                  1.015785D+02          -2.363390D-02
                  3.147551D+01           8.663170D-02
                  1.343728D+01           1.685839D-01
                  4.008690D+00          -2.091425D-01
                  1.684929D+00          -4.500918D-01
                  3.000190D-01           6.603978D-01
                  1.135870D-01           5.284152D-01
            S    1   1.00
                  1.135870D-01           1.000000D+00
            S    1   1.00
                  0.0411520              1.0000000
            P    11   1.00
                  3.886356D+03           1.409700D-03
                  9.212020D+02           1.182770D-02
                  2.971932D+02           5.932800D-02
                  1.119751D+02           1.965115D-01
                  4.603462D+01           3.997891D-01
                  1.987419D+01           4.004653D-01
                  8.386088D+00           1.164196D-01
                  3.558728D+00           6.918000D-04
                  1.447282D+00           2.163300D-03
                  3.477790D-01          -4.150000D-04
                  1.076990D-01           1.452000D-04
            P    11   1.00
                  3.886356D+03          -5.519000D-04
                  9.212020D+02          -4.655000D-03
                  2.971932D+02          -2.391760D-02
                  1.119751D+02          -8.256270D-02
                  4.603462D+01          -1.806791D-01
                  1.987419D+01          -1.724848D-01
                  8.386088D+00           2.086700D-01
                  3.558728D+00           5.823622D-01
                  1.447282D+00           3.537465D-01
                  3.477790D-01           2.064390D-02
                  1.076990D-01          -3.638200D-03
            P    11   1.00
                  3.886356D+03           1.236000D-04
                  9.212020D+02           1.024000D-03
                  2.971932D+02           5.380500D-03
                  1.119751D+02           1.824430D-02
                  4.603462D+01           4.159790D-02
                  1.987419D+01           3.629980D-02
                  8.386088D+00          -5.235690D-02
                  3.558728D+00          -1.791667D-01
                  1.447282D+00          -7.404770D-02
                  3.477790D-01           5.358094D-01
                  1.076990D-01           5.888104D-01
            P    1   1.00
                  1.076990D-01           1.000000D+00
            P    1   1.00
                  0.0312680              1.0000000
            D    5   1.00
                  8.442423D+01           2.452880D-02
                  2.418159D+01           1.411340D-01
                  8.401777D+00           3.687579D-01
                  2.980502D+00           4.840626D-01
                  9.790030D-01           2.824434D-01
            D    1   1.00
                  3.098000D-01           1.000000D+00
            D    1   1.00
                  0.1078000              1.0000000
            ****
            -Se     0
            S    14   1.00
                  5.989900D+05           2.004000D-04
                  8.978300D+04           1.555400D-03
                  2.043500D+04           8.087200D-03
                  5.786900D+03           3.303440D-02
                  1.887300D+03           1.082924D-01
                  6.809700D+02           2.703361D-01
                  2.653900D+02           4.206236D-01
                  1.086300D+02           2.815922D-01
                  3.376000D+01           3.081100D-02
                  1.446500D+01          -7.161700D-03
                  4.389000D+00           2.602200D-03
                  1.878300D+00          -1.258300D-03
                  3.585900D-01           3.465000D-04
                  1.364900D-01          -1.503000D-04
            S    14   1.00
                  5.989900D+05          -6.290000D-05
                  8.978300D+04          -4.850000D-04
                  2.043500D+04          -2.564400D-03
                  5.786900D+03          -1.047610D-02
                  1.887300D+03          -3.672230D-02
                  6.809700D+02          -9.992250D-02
                  2.653900D+02          -2.141973D-01
                  1.086300D+02          -1.836593D-01
                  3.376000D+01           4.675454D-01
                  1.446500D+01           6.414740D-01
                  4.389000D+00           7.925690D-02
                  1.878300D+00          -1.426970D-02
                  3.585900D-01           3.379200D-03
                  1.364900D-01          -1.453700D-03
            S    14   1.00
                  5.989900D+05           2.470000D-05
                  8.978300D+04           1.913000D-04
                  2.043500D+04           1.006800D-03
                  5.786900D+03           4.151400D-03
                  1.887300D+03           1.449910D-02
                  6.809700D+02           4.056580D-02
                  2.653900D+02           8.853640D-02
                  1.086300D+02           8.542120D-02
                  3.376000D+01          -2.932581D-01
                  1.446500D+01          -5.570727D-01
                  4.389000D+00           5.261436D-01
                  1.878300D+00           7.320371D-01
                  3.585900D-01           3.882460D-02
                  1.364900D-01          -1.050360D-02
            S    14   1.00
                  5.989900D+05          -7.200000D-06
                  8.978300D+04          -5.590000D-05
                  2.043500D+04          -2.938000D-04
                  5.786900D+03          -1.213600D-03
                  1.887300D+03          -4.234000D-03
                  6.809700D+02          -1.190350D-02
                  2.653900D+02          -2.602060D-02
                  1.086300D+02          -2.561480D-02
                  3.376000D+01           9.194270D-02
                  1.446500D+01           1.838700D-01
                  4.389000D+00          -2.188461D-01
                  1.878300D+00          -4.896524D-01
                  3.585900D-01           6.775818D-01
                  1.364900D-01           5.296721D-01
            S    1   1.00
                  1.364900D-01           1.000000D+00
            S    1   1.00
                  0.0487470              1.0000000
            P    11   1.00
                  4.135600D+03           1.412700D-03
                  9.803400D+02           1.185880D-02
                  3.163500D+02           5.951530D-02
                  1.192500D+02           1.972201D-01
                  4.906800D+01           4.007439D-01
                  2.121200D+01           3.994740D-01
                  8.946200D+00           1.153364D-01
                  3.823600D+00           2.219000D-04
                  1.588300D+00           2.283800D-03
                  4.096900D-01          -4.756000D-04
                  1.245900D-01           1.516000D-04
            P    11   1.00
                  4.135600D+03          -5.610000D-04
                  9.803400D+02          -4.734000D-03
                  3.163500D+02          -2.435040D-02
                  1.192500D+02          -8.410710D-02
                  4.906800D+01          -1.841384D-01
                  2.121200D+01          -1.735004D-01
                  8.946200D+00           2.167263D-01
                  3.823600D+00           5.850099D-01
                  1.588300D+00           3.416816D-01
                  4.096900D-01           1.991250D-02
                  1.245900D-01          -2.613100D-03
            P    11   1.00
                  4.135600D+03           1.366000D-04
                  9.803400D+02           1.130800D-03
                  3.163500D+02           5.958100D-03
                  1.192500D+02           2.018660D-02
                  4.906800D+01           4.619390D-02
                  2.121200D+01           3.940500D-02
                  8.946200D+00          -5.928460D-02
                  3.823600D+00          -2.014663D-01
                  1.588300D+00          -6.878210D-02
                  4.096900D-01           5.595944D-01
                  1.245900D-01           5.709784D-01
            P    1   1.00
                  1.245900D-01           1.000000D+00
            P    1   1.00
                  0.0354920              1.0000000
            D    5   1.00
                  9.447200D+01           2.349820D-02
                  2.718000D+01           1.375183D-01
                  9.506800D+00           3.664824D-01
                  3.416800D+00           4.874717D-01
                  1.147900D+00           2.765769D-01
            D    1   1.00
                  3.682000D-01           1.000000D+00
            D    1   1.00
                  0.1283000              1.0000000
            ****
            -Br     0
            S    14   1.00
                  6.401000D+05           1.984000D-04
                  9.593800D+04           1.540000D-03
                  2.183300D+04           8.009600D-03
                  6.181900D+03           3.273410D-02
                  2.015700D+03           1.074480D-01
                  7.271000D+02           2.688946D-01
                  2.832800D+02           4.204411D-01
                  1.159100D+02           2.838041D-01
                  3.612400D+01           3.154550D-02
                  1.553200D+01          -7.426800D-03
                  4.785700D+00           2.772800D-03
                  2.081700D+00          -1.363500D-03
                  4.202800D-01           3.812000D-04
                  1.606900D-01          -1.615000D-04
            S    14   1.00
                  6.401000D+05          -6.250000D-05
                  9.593800D+04          -4.816000D-04
                  2.183300D+04          -2.546600D-03
                  6.181900D+03          -1.041120D-02
                  2.015700D+03          -3.651790D-02
                  7.271000D+02          -9.962950D-02
                  2.832800D+02          -2.141310D-01
                  1.159100D+02          -1.860911D-01
                  3.612400D+01           4.628261D-01
                  1.553200D+01           6.441141D-01
                  4.785700D+00           8.255020D-02
                  2.081700D+00          -1.496940D-02
                  4.202800D-01           3.528800D-03
                  1.606900D-01          -1.490900D-03
            S    14   1.00
                  6.401000D+05           2.480000D-05
                  9.593800D+04           1.919000D-04
                  2.183300D+04           1.010000D-03
                  6.181900D+03           4.165900D-03
                  2.015700D+03           1.456830D-02
                  7.271000D+02           4.083450D-02
                  2.832800D+02           8.948590D-02
                  1.159100D+02           8.727860D-02
                  3.612400D+01          -2.933644D-01
                  1.553200D+01          -5.667109D-01
                  4.785700D+00           5.105658D-01
                  2.081700D+00           7.477214D-01
                  4.202800D-01           4.215120D-02
                  1.606900D-01          -1.066120D-02
            S    14   1.00
                  6.401000D+05          -7.600000D-06
                  9.593800D+04          -5.880000D-05
                  2.183300D+04          -3.092000D-04
                  6.181900D+03          -1.276600D-03
                  2.015700D+03          -4.463400D-03
                  7.271000D+02          -1.255750D-02
                  2.832800D+02          -2.761450D-02
                  1.159100D+02          -2.739450D-02
                  3.612400D+01           9.640940D-02
                  1.553200D+01           1.976871D-01
                  4.785700D+00          -2.266693D-01
                  2.081700D+00          -5.241165D-01
                  4.202800D-01           6.889865D-01
                  1.606900D-01           5.344331D-01
            S    1   1.00
                  1.606900D-01           1.000000D+00
            S    1   1.00
                  0.0569460              1.0000000
            P    11   1.00
                  4.340800D+03           1.444800D-03
                  1.028900D+03           1.212880D-02
                  3.320200D+02           6.080770D-02
                  1.251600D+02           2.009358D-01
                  5.151100D+01           4.047419D-01
                  2.228100D+01           3.957151D-01
                  9.341700D+00           1.102213D-01
                  4.013200D+00          -9.090000D-04
                  1.700200D+00           2.483200D-03
                  4.719400D-01          -5.744000D-04
                  1.442100D-01           1.691000D-04
            P    11   1.00
                  4.340800D+03          -5.819000D-04
                  1.028900D+03          -4.906500D-03
                  3.320200D+02          -2.525140D-02
                  1.251600D+02          -8.694450D-02
                  5.151100D+01          -1.893422D-01
                  2.228100D+01          -1.710882D-01
                  9.341700D+00           2.368755D-01
                  4.013200D+00           5.898400D-01
                  1.700200D+00           3.171944D-01
                  4.719400D-01           1.798330D-02
                  1.442100D-01          -1.468300D-03
            P    11   1.00
                  4.340800D+03           1.518000D-04
                  1.028900D+03           1.256300D-03
                  3.320200D+02           6.622400D-03
                  1.251600D+02           2.238160D-02
                  5.151100D+01           5.097170D-02
                  2.228100D+01           4.140090D-02
                  9.341700D+00          -7.039700D-02
                  4.013200D+00          -2.232540D-01
                  1.700200D+00          -5.641790D-02
                  4.719400D-01           5.808079D-01
                  1.442100D-01           5.508132D-01
            P    1   1.00
                  1.442100D-01           1.000000D+00
            P    1   1.00
                  0.0410490              1.0000000
            D    5   1.00
                  1.048300D+02           2.265830D-02
                  3.027200D+01           1.345895D-01
                  1.064900D+01           3.647181D-01
                  3.869600D+00           4.904196D-01
                  1.323900D+00           2.713885D-01
            D    1   1.00
                  4.098000D-01           1.000000D+00
            D    1   1.00
                  0.1719000              1.0000000
            ****
            -Kr     0
            S    14   1.00
                  6.813588D+05           1.969000D-04
                  1.021265D+05           1.528600D-03
                  2.324371D+04           7.950000D-03
                  6.582007D+03           3.249380D-02
                  2.146429D+03           1.067240D-01
                  7.743378D+02           2.675701D-01
                  3.016702D+02           4.201851D-01
                  1.234118D+02           2.858015D-01
                  3.856755D+01           3.224610D-02
                  1.663738D+01          -7.682800D-03
                  5.198795D+00           2.939300D-03
                  2.294814D+00          -1.466200D-03
                  4.852110D-01           4.144000D-04
                  1.862700D-01          -1.720000D-04
            S    14   1.00
                  6.813588D+05          -6.220000D-05
                  1.021265D+05          -4.794000D-04
                  2.324371D+04          -2.534100D-03
                  6.582007D+03          -1.036360D-02
                  2.146429D+03          -3.635160D-02
                  7.743378D+02          -9.937370D-02
                  3.016702D+02          -2.140610D-01
                  1.234118D+02          -1.883192D-01
                  3.856755D+01           4.583816D-01
                  1.663738D+01           6.465664D-01
                  5.198795D+00           8.565790D-02
                  2.294814D+00          -1.561230D-02
                  4.852110D-01           3.649000D-03
                  1.862700D-01          -1.518900D-03
            S    14   1.00
                  6.813588D+05           2.490000D-05
                  1.021265D+05           1.928000D-04
                  2.324371D+04           1.014900D-03
                  6.582007D+03           4.185700D-03
                  2.146429D+03           1.464590D-02
                  7.743378D+02           4.110700D-02
                  3.016702D+02           9.039550D-02
                  1.234118D+02           8.906230D-02
                  3.856755D+01          -2.935718D-01
                  1.663738D+01          -5.759698D-01
                  5.198795D+00           4.968578D-01
                  2.294814D+00           7.616895D-01
                  4.852110D-01           4.532670D-02
                  1.862700D-01          -1.077220D-02
            S    14   1.00
                  6.813588D+05          -7.900000D-06
                  1.021265D+05          -6.140000D-05
                  2.324371D+04          -3.230000D-04
                  6.582007D+03          -1.333000D-03
                  2.146429D+03          -4.667200D-03
                  7.743378D+02          -1.313520D-02
                  3.016702D+02          -2.903420D-02
                  1.234118D+02          -2.901730D-02
                  3.856755D+01           1.002664D-01
                  1.663738D+01           2.103818D-01
                  5.198795D+00          -2.332471D-01
                  2.294814D+00          -5.546497D-01
                  4.852110D-01           6.969522D-01
                  1.862700D-01           5.408152D-01
            S    1   1.00
                  1.862700D-01           1.000000D+00
            S    1   1.00
                  0.0651450              1.0000000
            P    11   1.00
                  4.474270D+03           1.519500D-03
                  1.060579D+03           1.274240D-02
                  3.422081D+02           6.364650D-02
                  1.289984D+02           2.085635D-01
                  5.308722D+01           4.122423D-01
                  2.295942D+01           3.878103D-01
                  9.507300D+00           1.003820D-01
                  4.083055D+00          -2.507800D-03
                  1.750446D+00           2.713900D-03
                  5.291900D-01          -6.977000D-04
                  1.643690D-01           2.107000D-04
            P    11   1.00
                  4.474270D+03          -6.208000D-04
                  1.060579D+03          -5.221200D-03
                  3.422081D+02          -2.684630D-02
                  1.289984D+02          -9.158230D-02
                  5.308722D+01          -1.968164D-01
                  2.295942D+01          -1.634750D-01
                  9.507300D+00           2.738204D-01
                  4.083055D+00           5.981592D-01
                  1.750446D+00           2.750453D-01
                  5.291900D-01           1.277060D-02
                  1.643690D-01          -1.013500D-03
            P    11   1.00
                  4.474270D+03           1.701000D-04
                  1.060579D+03           1.406400D-03
                  3.422081D+02           7.396300D-03
                  1.289984D+02           2.482540D-02
                  5.308722D+01           5.571550D-02
                  2.295942D+01           4.121320D-02
                  9.507300D+00          -8.760570D-02
                  4.083055D+00          -2.440586D-01
                  1.750446D+00          -2.950070D-02
                  5.291900D-01           6.012295D-01
                  1.643690D-01           5.254807D-01
            P    1   1.00
                  1.643690D-01           1.000000D+00
            P    1   1.00
                  0.0466060              1.0000000
            D    5   1.00
                  1.155253D+02           2.195570D-02
                  3.346525D+01           1.321620D-01
                  1.183046D+01           3.633484D-01
                  4.339771D+00           4.929582D-01
                  1.507524D+00           2.667560D-01
            D    1   1.00
                  5.030000D-01           1.000000D+00
            D    1   1.00
                  0.2155000              1.0000000
            ****
            -Y     0
            S    7   1.00
                 29.2935000              0.0066660
                 16.6827000             -0.0497340
                 10.4235000              0.1315590
                  3.0952600             -0.5243820
                  0.7079710              0.7863790
                  0.3225670              0.4639580
                  0.0690850              0.0204860
            S    7   1.00
                 29.2935000             -0.0013580
                 16.6827000              0.0123920
                 10.4235000             -0.0375720
                  3.0952600              0.1741090
                  0.7079710             -0.3385090
                  0.3225670             -0.3354170
                  0.0690850              0.6581470
            S    7   1.00
                 29.2935000              0.0112420
                 16.6827000             -0.0574010
                 10.4235000              0.1106480
                  3.0952600             -0.3769430
                  0.7079710              1.2026360
                  0.3225670             -0.4875820
                  0.0690850             -1.8636390
            S    1   1.00
                  0.0274150              1.0000000
            S    1   1.00
                  0.0109000              1.0000000
            P    6   1.00
                  9.0271500              0.0203960
                  4.0242700             -0.1536620
                  0.9906740              0.4320820
                  0.4727970              0.4983480
                  0.2197340              0.1957420
                  0.0800880              0.0140830
            P    6   1.00
                  9.0271500             -0.0056190
                  4.0242700              0.0465110
                  0.9906740             -0.1495270
                  0.4727970             -0.2243370
                  0.2197340             -0.0114700
                  0.0800880              0.6364970
            P    6   1.00
                  9.0271500              0.0111310
                  4.0242700             -0.0963010
                  0.9906740              0.2986850
                  0.4727970              0.8892190
                  0.2197340             -1.4854780
                  0.0800880             -0.1131120
            P    1   1.00
                  0.0306400              1.0000000
            P    1   1.00
                  0.0117000              1.0000000
            D    5   1.00
                  4.3045000             -0.0043910
                  1.3201900              0.1196820
                  0.5614050              0.2962740
                  0.2267020              0.3908730
                  0.0879490              0.3539610
            D    5   1.00
                  4.3045000              0.0044330
                  1.3201900             -0.1499100
                  0.5614050             -0.3732930
                  0.2267020             -0.3129870
                  0.0879490              0.4218970
            D    1   1.00
                  0.0323050              1.0000000
            D    1   1.00
                  0.0119000              1.0000000
            F    1   1.00
                  0.2028000              1.0000000
            F    1   1.00
                  0.0484000              1.0000000
            ****
            -Zr     0
            S    7   1.00
                 53.4460000              0.0014860
                 17.0981000             -0.0365920
                 10.6875000              0.1321550
                  3.3913400             -0.5464540
                  0.7884750              0.8022910
                  0.3599820              0.4583040
                  0.0777920              0.0203880
            S    7   1.00
                 53.4460000             -0.0003080
                 17.0981000              0.0096310
                 10.6875000             -0.0390430
                  3.3913400              0.1847170
                  0.7884750             -0.3584690
                  0.3599820             -0.3208280
                  0.0777920              0.6560480
            S    7   1.00
                 53.4460000              0.0028110
                 17.0981000             -0.0412920
                 10.6875000              0.1148910
                  3.3913400             -0.4348090
                  0.7884750              1.4174320
                  0.3599820             -0.7286190
                  0.0777920             -1.6769590
            S    1   1.00
                  0.0302340              1.0000000
            S    1   1.00
                  0.0118000              1.0000000
            P    6   1.00
                  9.9011600              0.0214360
                  4.4181900             -0.1604130
                  1.0931000              0.4543260
                  0.5187860              0.4991190
                  0.2363630              0.1777830
                  0.0847070              0.0104040
            P    6   1.00
                  9.9011600             -0.0058310
                  4.4181900              0.0481520
                  1.0931000             -0.1600800
                  0.5187860             -0.2201350
                  0.2363630              0.0355150
                  0.0847070              0.6181780
            P    6   1.00
                  9.9011600             -0.0078290
                  4.4181900              0.0660080
                  1.0931000             -0.2113740
                  0.5187860             -0.3575490
                  0.2363630              0.1703870
                  0.0847070              0.8518400
            P    1   1.00
                  0.0311380              1.0000000
            P    1   1.00
                  0.0114000              1.0000000
            D    5   1.00
                  4.3948700             -0.0082920
                  1.5708900              0.1278490
                  0.6923540              0.3219090
                  0.2904140              0.3998190
                  0.1158780              0.3194760
            D    5   1.00
                  4.3948700              0.0084760
                  1.5708900             -0.1579890
                  0.6923540             -0.3979000
                  0.2904140             -0.2555990
                  0.1158780              0.4914180
            D    1   1.00
                  0.0429250              1.0000000
            D    1   1.00
                  0.0159000              1.0000000
            F    1   1.00
                  0.3272000              1.0000000
            F    1   1.00
                  0.0891000              1.0000000
            ****
            -Nb     0
            S    7   1.00
                 80.8096000              0.0008890
                 17.9220000             -0.0347930
                 11.2050000              0.1389100
                  3.6990100             -0.5655680
                  0.8712090              0.8147210
                  0.3974440              0.4547970
                  0.0854690              0.0200510
            S    7   1.00
                 80.8096000             -0.0002000
                 17.9220000              0.0093020
                 11.2050000             -0.0414910
                  3.6990100              0.1923710
                  0.8712090             -0.3713520
                  0.3974440             -0.3068350
                  0.0854690              0.6546160
            S    7   1.00
                 80.8096000              0.0015640
                 17.9220000             -0.0382840
                 11.2050000              0.1209450
                  3.6990100             -0.4647790
                  0.8712090              1.5031600
                  0.3974440             -0.8262330
                  0.0854690             -1.5845850
            S    1   1.00
                  0.0326640              1.0000000
            S    1   1.00
                  0.0125000              1.0000000
            P    6   1.00
                 10.6457000              0.0234360
                  4.8235100             -0.1683110
                  1.2030900              0.4693810
                  0.5695080              0.4980520
                  0.2569700              0.1675400
                  0.0929460              0.0087660
            P    6   1.00
                 10.6457000             -0.0064960
                  4.8235100              0.0513810
                  1.2030900             -0.1706080
                  0.5695080             -0.2198720
                  0.2569700              0.0561670
                  0.0929460              0.6165950
            P    6   1.00
                 10.6457000             -0.0091300
                  4.8235100              0.0732300
                  1.2030900             -0.2370360
                  0.5695080             -0.3685640
                  0.2569700              0.2364390
                  0.0929460              0.8267330
            P    1   1.00
                  0.0338800              1.0000000
            P    1   1.00
                  0.0123000              1.0000000
            D    5   1.00
                  4.5456300             -0.0104650
                  1.8272300              0.1305530
                  0.8257640              0.3347580
                  0.3551560              0.4020270
                  0.1447240              0.3008350
            D    5   1.00
                  4.5456300              0.0105280
                  1.8272300             -0.1615000
                  0.8257640             -0.4113720
                  0.3551560             -0.2117820
                  0.1447240              0.4861590
            D    1   1.00
                  0.0543230              1.0000000
            D    1   1.00
                  0.0204000              1.0000000
            F    1   1.00
                  0.4690000              1.0000000
            F    1   1.00
                  0.1387000              1.0000000
            ****
            -Mo     0
            S    7   1.00
                106.9780000              0.0007350
                 18.8824000             -0.0350900
                 11.8077000              0.1473480
                  4.0211800             -0.5833630
                  0.9568160              0.8256350
                  0.4356920              0.4523110
                  0.0925180              0.0190550
            S    7   1.00
                106.9780000             -0.0001760
                 18.8824000              0.0093320
                 11.8077000             -0.0438110
                  4.0211800              0.1972320
                  0.9568160             -0.3773110
                  0.4356920             -0.2939670
                  0.0925180              0.6498330
            S    7   1.00
                106.9780000              0.0011660
                 18.8824000             -0.0376070
                 11.8077000              0.1259800
                  4.0211800             -0.4752370
                  0.9568160              1.4989830
                  0.4356920             -0.8223450
                  0.0925180             -1.5606240
            S    1   1.00
                  0.0348540              1.0000000
            S    1   1.00
                  0.0131000              1.0000000
            P    6   1.00
                 11.4118000              0.0253450
                  5.2453500             -0.1752130
                  1.3188400              0.4812720
                  0.6229830              0.4972610
                  0.2791080              0.1595550
                  0.1005260              0.0075430
            P    6   1.00
                 11.4118000             -0.0070220
                  5.2453500              0.0533390
                  1.3188400             -0.1756430
                  0.6229830             -0.2162130
                  0.2791080              0.0679580
                  0.1005260              0.6128160
            P    6   1.00
                 11.4118000             -0.0104200
                  5.2453500              0.0798670
                  1.3188400             -0.2629000
                  0.6229830             -0.3651840
                  0.2791080              0.2866730
                  0.1005260              0.8002580
            P    1   1.00
                  0.0362770              1.0000000
            P    1   1.00
                  0.0131000              1.0000000
            D    5   1.00
                  5.2576100             -0.0147610
                  2.1046200              0.1319820
                  0.9582010              0.3470860
                  0.4140470              0.4054710
                  0.1684500              0.2880580
            D    5   1.00
                  5.2576100              0.0154390
                  2.1046200             -0.1606210
                  0.9582010             -0.4232290
                  0.4140470             -0.1923390
                  0.1684500              0.5314590
            D    1   1.00
                  0.0623420              1.0000000
            D    1   1.00
                  0.0231000              1.0000000
            F    1   1.00
                  0.6007000              1.0000000
            F    1   1.00
                  0.1850000              1.0000000
            ****
            -Tc     0
            S    7   1.00
                132.6560000              0.0006860
                 19.8986000             -0.0360010
                 12.4450000              0.1564650
                  4.3605000             -0.5995730
                  1.0443600              0.8357100
                  0.4741590              0.4490550
                  0.0987360              0.0183780
            S    7   1.00
                132.6560000             -0.0001680
                 19.8986000              0.0093110
                 12.4450000             -0.0455350
                  4.3605000              0.1986020
                  1.0443600             -0.3749740
                  0.4741590             -0.2817600
                  0.0987360              0.6329980
            S    7   1.00
                132.6560000              0.0009800
                 19.8986000             -0.0378410
                 12.4450000              0.1317670
                  4.3605000             -0.4834180
                  1.0443600              1.4848540
                  0.4741590             -0.8047310
                  0.0987360             -1.5511910
            S    1   1.00
                  0.0367360              1.0000000
            S    1   1.00
                  0.0137000              1.0000000
            P    6   1.00
                 12.1789000              0.0273140
                  5.6848400             -0.1814030
                  1.4398300              0.4908910
                  0.6789090              0.4965410
                  0.3025150              0.1532990
                  0.1073070              0.0067000
            P    6   1.00
                 12.1789000             -0.0074300
                  5.6848400              0.0541370
                  1.4398300             -0.1762270
                  0.6789090             -0.2096540
                  0.3025150              0.0734980
                  0.1073070              0.6070490
            P    6   1.00
                 12.1789000             -0.0116300
                  5.6848400              0.0854050
                  1.4398300             -0.2844050
                  0.6789090             -0.3578760
                  0.3025150              0.3260330
                  0.1073070              0.7801240
            P    1   1.00
                  0.0381770              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  5.7601300             -0.0164110
                  2.3642400              0.1344070
                  1.0887100              0.3547260
                  0.4740600              0.4044790
                  0.1936070              0.2788770
            D    5   1.00
                  5.7601300              0.0169910
                  2.3642400             -0.1548960
                  1.0887100             -0.4281920
                  0.4740600             -0.1789920
                  0.1936070              0.5346560
            D    1   1.00
                  0.0714600              1.0000000
            D    1   1.00
                  0.0264000              1.0000000
            F    1   1.00
                  0.7228000              1.0000000
            F    1   1.00
                  0.2272000              1.0000000
            ****
            -Ru     0
            S    7   1.00
                159.3720000              0.0006730
                 20.9016000             -0.0371610
                 13.0741000              0.1665170
                  4.7147400             -0.6159540
                  1.1361200              0.8428300
                  0.5154640              0.4477630
                  0.1067670              0.0184450
            S    7   1.00
                159.3720000             -0.0001690
                 20.9016000              0.0093920
                 13.0741000             -0.0477130
                  4.7147400              0.2011130
                  1.1361200             -0.3734210
                  0.5154640             -0.2738590
                  0.1067670              0.6093840
            S    7   1.00
                159.3720000              0.0008950
                 20.9016000             -0.0396350
                 13.0741000              0.1442430
                  4.7147400             -0.5192870
                  1.1361200              1.5854040
                  0.5154640             -0.9082030
                  0.1067670             -1.4720020
            S    1   1.00
                  0.0392180              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                 12.8738000              0.0299680
                  6.1475000             -0.1879300
                  1.5652400              0.4999900
                  0.7361940              0.4957320
                  0.3263170              0.1475150
                  0.1124070              0.0060880
            P    6   1.00
                 12.8738000             -0.0078010
                  6.1475000              0.0536560
                  1.5652400             -0.1719400
                  0.7361940             -0.1991700
                  0.3263170              0.0744110
                  0.1124070              0.5971370
            P    6   1.00
                 12.8738000             -0.0135020
                  6.1475000              0.0937330
                  1.5652400             -0.3159100
                  0.7361940             -0.3618000
                  0.3263170              0.4008770
                  0.1124070              0.7537660
            P    1   1.00
                  0.0391720              1.0000000
            P    1   1.00
                  0.0137000              1.0000000
            D    5   1.00
                  6.2126500             -0.0245970
                  2.7853900              0.1273340
                  1.2685100              0.3570810
                  0.5517900              0.4082070
                  0.2247310              0.2812400
            D    5   1.00
                  6.2126500              0.0261160
                  2.7853900             -0.1459400
                  1.2685100             -0.4425210
                  0.5517900             -0.1690200
                  0.2247310              0.5052370
            D    1   1.00
                  0.0824110              1.0000000
            D    1   1.00
                  0.0302000              1.0000000
            F    1   1.00
                  0.8500000              1.0000000
            F    1   1.00
                  0.2719000              1.0000000
            ****
            -Rh     0
            S    7   1.00
                184.6660000              0.0006920
                 21.9974000             -0.0383930
                 13.7616000              0.1760190
                  5.0872000             -0.6299250
                  1.2294000              0.8495440
                  0.5568140              0.4457290
                  0.1140670              0.0182040
            S    7   1.00
                184.6660000             -0.0001780
                 21.9974000              0.0094560
                 13.7616000             -0.0494720
                  5.0872000              0.2018670
                  1.2294000             -0.3698090
                  0.5568140             -0.2653310
                  0.1140670              0.5891540
            S    7   1.00
                184.6660000              0.0008370
                 21.9974000             -0.0402860
                 13.7616000              0.1506490
                  5.0872000             -0.5268510
                  1.2294000              1.5723820
                  0.5568140             -0.8876430
                  0.1140670             -1.4709450
            S    1   1.00
                  0.0414150              1.0000000
            S    1   1.00
                  0.0150000              1.0000000
            P    6   1.00
                 13.6985000              0.0318210
                  6.6247600             -0.1930280
                  1.6961300              0.5062420
                  0.7973510              0.4949020
                  0.3520340              0.1440300
                  0.1233420              0.0056080
            P    6   1.00
                 13.6985000             -0.0085830
                  6.6247600              0.0568110
                  1.6961300             -0.1801720
                  0.7973510             -0.2034110
                  0.3520340              0.0848180
                  0.1233420              0.6010570
            P    6   1.00
                 13.6985000             -0.0151640
                  6.6247600              0.1011250
                  1.6961300             -0.3456410
                  0.7973510             -0.3454850
                  0.3520340              0.4221020
                  0.1233420              0.7304790
            P    1   1.00
                  0.0431300              1.0000000
            P    1   1.00
                  0.0151000              1.0000000
            D    5   1.00
                 18.7370000              0.0064810
                 11.7046000             -0.0139420
                  2.2555800              0.2506820
                  0.9494110              0.4511110
                  0.3661640              0.3839990
            D    5   1.00
                 18.7370000             -0.0075900
                 11.7046000              0.0162940
                  2.2555800             -0.3347730
                  0.9494110             -0.4463960
                  0.3661640              0.3299670
            D    1   1.00
                  0.1239770              1.0000000
            D    1   1.00
                  0.0420000              1.0000000
            F    1   1.00
                  0.9936000              1.0000000
            F    1   1.00
                  0.3222000              1.0000000
            ****
            -Pd     0
            S    7   1.00
                208.1230000              0.0007270
                 22.8525000             -0.0409280
                 14.2986000              0.1922850
                  5.4880100             -0.6501040
                  1.3253200              0.8565530
                  0.5989570              0.4438760
                  0.1209830              0.0178500
            S    7   1.00
                208.1230000             -0.0001890
                 22.8525000              0.0098180
                 14.2986000             -0.0528760
                  5.4880100              0.2035110
                  1.3253200             -0.3639350
                  0.5989570             -0.2582190
                  0.1209830              0.5704320
            S    7   1.00
                208.1230000              0.0008000
                 22.8525000             -0.0417810
                 14.2986000              0.1593620
                  5.4880100             -0.5231230
                  1.3253200              1.4917730
                  0.5989570             -0.7916960
                  0.1209830             -1.5172540
            S    1   1.00
                  0.0434590              1.0000000
            S    1   1.00
                  0.0156000              1.0000000
            P    6   1.00
                 14.0509000              0.0379970
                  7.1390600             -0.2040770
                  1.8300700              0.5137680
                  0.8583350              0.4942400
                  0.3772750              0.1402910
                  0.1256960              0.0051570
            P    6   1.00
                 14.0509000             -0.0093130
                  7.1390600              0.0546710
                  1.8300700             -0.1661610
                  0.8583350             -0.1858420
                  0.3772750              0.0731610
                  0.1256960              0.5861720
            P    6   1.00
                 14.0509000             -0.0186030
                  7.1390600              0.1098650
                  1.8300700             -0.3664000
                  0.8583350             -0.3473160
                  0.3772750              0.4820340
                  0.1256960              0.7096400
            P    1   1.00
                  0.0426590              1.0000000
            P    1   1.00
                  0.0145000              1.0000000
            D    5   1.00
                 19.2539000              0.0066240
                 10.5848000             -0.0184110
                  2.4561900              0.2633960
                  1.0352900              0.4524480
                  0.4020080              0.3758330
            D    5   1.00
                 19.2539000             -0.0078390
                 10.5848000              0.0218380
                  2.4561900             -0.3691550
                  1.0352900             -0.4309590
                  0.4020080              0.3749650
            D    1   1.00
                  0.1370570              1.0000000
            D    1   1.00
                  0.0467000              1.0000000
            F    1   1.00
                  1.1484000              1.0000000
            F    1   1.00
                  0.3788000              1.0000000
            ****
            -Ag     0
            S    8   1.00
                180.0750000              0.0008490
                 21.8987000             -0.0654500
                 13.8670000              0.2977650
                  6.1426300             -0.7531210
                  1.4381400              0.8811750
                  0.6483820              0.4351760
                  0.1288820              0.0147380
                  0.0457380             -0.0013990
            S    8   1.00
                180.0750000             -0.0002030
                 21.8987000              0.0157230
                 13.8670000             -0.0792290
                  6.1426300              0.2226340
                  1.4381400             -0.3491960
                  0.6483820             -0.2559780
                  0.1288820              0.5486660
                  0.0457380              0.6181030
            S    8   1.00
                180.0750000             -0.0008620
                 21.8987000              0.0525460
                 13.8670000             -0.2081000
                  6.1426300              0.5249720
                  1.4381400             -1.2701730
                  0.6483820              0.5393730
                  0.1288820              1.6533910
                  0.0457380             -1.5839750
            S    1   1.00
                  0.0457380              1.0000000
            S    1   1.00
                  0.0162000              1.0000000
            P    7   1.00
                 11.8751000              0.1162480
                  8.0024500             -0.3072860
                  2.0176600              0.5157360
                  0.9542300              0.5031040
                  0.4231180              0.1420950
                  0.1358850              0.0051530
                  0.0454010              0.0001040
            P    7   1.00
                 11.8751000             -0.0282840
                  8.0024500              0.0783470
                  2.0176600             -0.1567410
                  0.9542300             -0.1886250
                  0.4231180              0.0635650
                  0.1358850              0.5817780
                  0.0454010              0.4999110
            P    7   1.00
                 11.8751000             -0.0528570
                  8.0024500              0.1470390
                  2.0176600             -0.3129730
                  0.9542300             -0.3708280
                  0.4231180              0.4236290
                  0.1358850              0.7536550
                  0.0454010              0.0708700
            P    1   1.00
                  0.0454010              1.0000000
            P    1   1.00
                  0.0152000              1.0000000
            D    6   1.00
                 26.4320000              0.0034790
                 11.0345000             -0.0138480
                  2.7378700              0.2545990
                  1.1957500              0.4498490
                  0.4820420              0.3757380
                  0.1729080              0.1458790
            D    6   1.00
                 26.4320000             -0.0047330
                 11.0345000              0.0190700
                  2.7378700             -0.4332980
                  1.1957500             -0.4445680
                  0.4820420              0.4914420
                  0.1729080              0.5728660
            D    1   1.00
                  0.1729080              1.0000000
            D    1   1.00
                  0.0620000              1.0000000
            F    1   1.00
                  1.3299000              1.0000000
            F    1   1.00
                  0.4449000              1.0000000
            ****
            -Cd     0
            S    8   1.00
                223.8530000              0.0008710
                 23.0948000             -0.0643070
                 14.6522000              0.3013160
                  6.5704440             -0.7605240
                  1.5378300              0.8940710
                  0.6909840              0.4278790
                  0.1349130              0.0101880
                  0.0474420             -0.0024450
            S    8   1.00
                223.8530000             -0.0002290
                 23.0948000              0.0155940
                 14.6522000             -0.0810470
                  6.5704440              0.2272510
                  1.5378300             -0.3625630
                  0.6909840             -0.2507830
                  0.1349130              0.6135330
                  0.0474420              0.5582600
            S    8   1.00
                223.8530000              0.0010770
                 23.0948000             -0.0716490
                 14.6522000              0.2889750
                  6.5704440             -0.7315460
                  1.5378300              1.9768990
                  0.6909840             -1.3519510
                  0.1349130             -1.1186740
                  0.0474420              1.3026160
            S    1   1.00
                  0.0474420              1.0000000
            S    1   1.00
                  0.0167000              1.0000000
            P    7   1.00
                 13.7175000              0.0776160
                  8.4632200             -0.2579430
                  2.1182000              0.5352740
                  0.9892620              0.4963620
                  0.4317810              0.1231090
                  0.1391600              0.0032100
                  0.0461490              0.0003400
            P    7   1.00
                 13.7175000             -0.0180110
                  8.4632200              0.0637170
                  2.1182000             -0.1587410
                  0.9892620             -0.1762800
                  0.4317810              0.0710060
                  0.1391600              0.5775860
                  0.0461490              0.4994910
            P    7   1.00
                 13.7175000             -0.0307300
                  8.4632200              0.1087440
                  2.1182000             -0.2782310
                  0.9892620             -0.3293900
                  0.4317810              0.3546300
                  0.1391600              0.7814580
                  0.0461490              0.0852520
            P    1   1.00
                  0.0461490              1.0000000
            P    1   1.00
                  0.0153000              1.0000000
            D    6   1.00
                 31.6697000              0.0031630
                 12.2214000             -0.0117910
                  3.1219900              0.2411940
                  1.3894100              0.4489980
                  0.5732030              0.3802110
                  0.2117080              0.1445530
            D    6   1.00
                 31.6697000             -0.0048710
                 12.2214000              0.0185820
                  3.1219900             -0.4766730
                  1.3894100             -0.4576040
                  0.5732030              0.5714620
                  0.2117080              0.4973800
            D    1   1.00
                  0.2117080              1.0000000
            D    1   1.00
                  0.0782000              1.0000000
            F    1   1.00
                  1.5393000              1.0000000
            F    1   1.00
                  0.5177000              1.0000000
            ****
            -In     0
            S    8   1.00
                265.1310000              0.0007700
                 25.5694000             -0.0527910
                 16.0041000              0.2593430
                  6.8188500             -0.7392890
                  1.6667600              0.8857730
                  0.7692320              0.4425920
                  0.1704150              0.0115740
                  0.0622300             -0.0024510
            S    8   1.00
                265.1310000             -0.0002300
                 25.5694000              0.0140880
                 16.0041000             -0.0786150
                  6.8188500              0.2528640
                  1.6667600             -0.4155450
                  0.7692320             -0.2966470
                  0.1704150              0.6785780
                  0.0622300              0.5271290
            S    1   1.00
                  0.1704150              1.0000000
            S    1   1.00
                  0.0622300              1.0000000
            S    1   1.00
                  0.0203000              1.0000000
            P    6   1.00
                 14.4691000              0.0901770
                  9.2808300             -0.2676420
                  2.0820100              0.6644830
                  0.8443140              0.4616900
                  0.1869000              0.0270590
                  0.0547770             -0.0046770
            P    6   1.00
                 14.4691000             -0.0190230
                  9.2808300              0.0591570
                  2.0820100             -0.1807490
                  0.8443140             -0.1145820
                  0.1869000              0.4407390
                  0.0547770              0.6877890
            P    1   1.00
                  0.0547770              1.0000000
            P    1   1.00
                  0.0141000              1.0000000
            D    6   1.00
                 30.7879000              0.0057660
                 19.2555000             -0.0107080
                  3.1966200              0.2938600
                  1.3321000              0.5108690
                  0.5046190              0.3415190
                  0.1498000              0.0524650
            D    1   1.00
                  0.1498000              1.0000000
            D    1   1.00
                  0.0472000              1.0000000
            ****
            -Sn     0
            S    8   1.00
                380.3660000              0.0011650
                 28.5822000             -0.0260060
                 17.8892000              0.1660430
                  6.9286200             -0.6589140
                  1.7839100              0.8693360
                  0.8431380              0.4521320
                  0.2052280              0.0129730
                  0.0766360             -0.0024030
            S    8   1.00
                380.3660000             -0.0004420
                 28.5822000              0.0057020
                 17.8892000             -0.0528940
                  6.9286200              0.2520870
                  1.7839100             -0.4703430
                  0.8431380             -0.3161440
                  0.2052280              0.7206250
                  0.0766360              0.5111140
            S    1   1.00
                  0.2052280              1.0000000
            S    1   1.00
                  0.0766360              1.0000000
            S    1   1.00
                  0.0275000              1.0000000
            P    6   1.00
                 18.5489000              0.0370210
                  9.5669600             -0.1938660
                  2.2186100              0.6575940
                  0.9214590              0.4555060
                  0.2178580              0.0272160
                  0.0693200             -0.0046040
            P    6   1.00
                 18.5489000             -0.0090520
                  9.5669600              0.0517620
                  2.2186100             -0.2217430
                  0.9214590             -0.1242790
                  0.2178580              0.5218530
                  0.0693200              0.6099370
            P    1   1.00
                  0.0693200              1.0000000
            P    1   1.00
                  0.0209000              1.0000000
            D    6   1.00
                 38.5626000              0.0042610
                 21.7613000             -0.0068970
                  3.6611100              0.2762770
                  1.5583300              0.5143230
                  0.6095230              0.3445590
                  0.1897000              0.0515940
            D    1   1.00
                  0.1897000              1.0000000
            D    1   1.00
                  0.0649000              1.0000000
            ****
            -Sb     0
            S    8   1.00
                371.5840000              0.0015910
                 26.5392000             -0.0416840
                 16.6213000              0.2733430
                  7.7355100             -0.7676850
                  1.8923400              0.8994960
                  0.9104310              0.4313870
                  0.2442310              0.0128370
                  0.0923970             -0.0021730
            S    8   1.00
                371.5840000              0.0006540
                 26.5392000             -0.0109620
                 16.6213000              0.0938330
                  7.7355100             -0.3040090
                  1.8923400              0.5084090
                  0.9104310              0.3392390
                  0.2442310             -0.7347720
                  0.0923970             -0.5261340
            S    1   1.00
                  0.2442310              1.0000000
            S    1   1.00
                  0.0923970              1.0000000
            S    1   1.00
                  0.0327000              1.0000000
            P    6   1.00
                 16.0509000              0.0921570
                 10.2621000             -0.2755590
                  2.4283200              0.6586400
                  1.0336000              0.4668920
                  0.2594400              0.0285110
                  0.0861080             -0.0051550
            P    6   1.00
                 16.0509000             -0.0253130
                 10.2621000              0.0797960
                  2.4283200             -0.2420940
                  1.0336000             -0.1486050
                  0.2594400              0.5489440
                  0.0861080              0.5892910
            P    1   1.00
                  0.0861080              1.0000000
            P    1   1.00
                  0.0271000              1.0000000
            D    6   1.00
                 45.4785000              0.0032590
                 18.5114000             -0.0054970
                  3.9160000              0.2799530
                  1.7148200              0.5127510
                  0.6973190              0.3328720
                  0.2304000              0.0488430
            D    1   1.00
                  0.2304000              1.0000000
            D    1   1.00
                  0.0802000              1.0000000
            ****
            -Te     0
            S    8   1.00
               2111.1900000              0.0006120
                311.6910000              0.0032070
                 13.8226000              0.4055120
                  8.7174800             -0.9325880
                  1.9830300              0.9196570
                  0.9703770              0.4046710
                  0.2797650              0.0123660
                  0.1067760             -0.0016040
            S    8   1.00
               2111.1900000              0.0002510
                311.6910000              0.0014570
                 13.8226000              0.1637020
                  8.7174800             -0.3984550
                  1.9830300              0.5780740
                  0.9703770              0.3271240
                  0.2797650             -0.7846540
                  0.1067760             -0.4994510
            S    1   1.00
                  0.2797650              1.0000000
            S    1   1.00
                  0.1067760              1.0000000
            S    1   1.00
                  0.0369000              1.0000000
            P    6   1.00
                 17.0629000              0.0893400
                 10.8306000             -0.2711680
                  2.5938000              0.6620230
                  1.1267600              0.4607440
                  0.3001760              0.0288090
                  0.0975510             -0.0038630
            P    6   1.00
                 17.0629000             -0.0268610
                 10.8306000              0.0863040
                  2.5938000             -0.2735020
                  1.1267600             -0.1513900
                  0.3001760              0.5839760
                  0.0975510              0.5650140
            P    1   1.00
                  0.0975510              1.0000000
            P    1   1.00
                  0.0299000              1.0000000
            D    6   1.00
                 50.9106000              0.0033540
                 18.4647000             -0.0036420
                  4.2761700              0.2780800
                  1.8977000              0.5163480
                  0.7864800              0.3265710
                  0.2638000              0.0451520
            D    1   1.00
                  0.2638000              1.0000000
            D    1   1.00
                  0.0988000              1.0000000
            ****
            -I     0
            S    8   1.00
                  2.449790D+03           4.190000D-04
                  3.598080D+02           2.240000D-03
                  1.440580D+01           3.972230D-01
                  9.076320D+00          -9.322490D-01
                  2.088100D+00           9.371380D-01
                  1.034980D+00           3.920860D-01
                  3.162840D-01           1.248500D-02
                  1.217190D-01          -1.329000D-03
            S    8   1.00
                  2.449790D+03           1.750000D-04
                  3.598080D+02           1.057000D-03
                  1.440580D+01           1.690000D-01
                  9.076320D+00          -4.217930D-01
                  2.088100D+00           6.388640D-01
                  1.034980D+00           3.201150D-01
                  3.162840D-01          -8.144280D-01
                  1.217190D-01          -4.897980D-01
            S    1   1.00
                  3.162840D-01           1.000000D+00
            S    1   1.00
                  1.217190D-01           1.000000D+00
            S    1   1.00
                  4.200000D-02           1.0000000
            P    6   1.00
                  1.953010D+01           5.893400D-02
                  1.108820D+01          -2.309300D-01
                  2.715630D+00           6.648010D-01
                  1.204300D+00           4.506730D-01
                  3.399450D-01           2.898000D-02
                  1.108810D-01          -2.889000D-03
            P    6   1.00
                  1.953010D+01          -1.883600D-02
                  1.108820D+01           8.000600D-02
                  2.715630D+00          -3.066520D-01
                  1.204300D+00          -1.475940D-01
                  3.399450D-01           6.075060D-01
                  1.108810D-01           5.470490D-01
            P    1   1.00
                  1.108810D-01           1.000000D+00
            P    1   1.00
                  3.380000D-02           1.0000000
            D    6   1.00
                  4.547650D+01           4.266000D-03
                  1.319280D+01          -1.362500D-02
                  4.227410D+00           3.097560D-01
                  1.942800D+00           5.097720D-01
                  8.397710D-01           2.974610D-01
                  3.000000D-01           4.016400D-02
            D    1   1.00
                  3.000000D-01           1.000000D+00
            D    1   1.00
                  1.191000D-01           1.0000000
            ****
            -Xe     0
            S    8   1.00
               2058.3200000              0.0009380
                307.4270000              0.0044200
                 15.7815000              0.3543950
                  9.5447000             -0.8885140
                  2.2296900              0.9496240
                  1.1120000              0.3810660
                  0.3554300              0.0125430
                  0.1377260             -0.0010730
            S    8   1.00
               2058.3200000             -0.0004380
                307.4270000             -0.0022770
                 15.7815000             -0.1557960
                  9.5447000              0.4175780
                  2.2296900             -0.6793250
                  1.1120000             -0.3183090
                  0.3554300              0.8356730
                  0.1377260              0.4854110
            S    1   1.00
                  0.3554300              1.0000000
            S    1   1.00
                  0.1377260              1.0000000
            S    1   1.00
                  0.0473000              1.0000000
            P    6   1.00
                 20.1725000              0.0687400
                 11.8122000             -0.2446140
                  2.9346000              0.6676480
                  1.3189000              0.4501800
                  0.3858160              0.0286890
                  0.1269610             -0.0034820
            P    6   1.00
                 20.1725000             -0.0229670
                 11.8122000              0.0881150
                  2.9346000             -0.3233110
                  1.3189000             -0.1542280
                  0.3858160              0.6228820
                  0.1269610              0.5375650
            P    1   1.00
                  0.1269610              1.0000000
            P    1   1.00
                  0.0379000              1.0000000
            D    6   1.00
                 52.6666000              0.0048070
                 14.3464000             -0.0045170
                  4.8159700              0.3015100
                  2.2149600              0.5120370
                  0.9611280              0.2990900
                  0.3412000              0.0395700
            D    1   1.00
                  0.3412000              1.0000000
            D    1   1.00
                  0.1404000              1.0000000
            ****
            -Hf     0
            S    7   1.00
                 29.2650000              0.0294330
                 18.3491000             -0.1987340
                 11.5257000              0.4359330
                  4.3859900             -0.7730970
                  0.8910800              0.8677580
                  0.4057400              0.4202920
                  0.0950670              0.0131930
            S    7   1.00
                 29.2650000             -0.0090770
                 18.3491000              0.0611920
                 11.5257000             -0.1354740
                  4.3859900              0.2530470
                  0.8910800             -0.3699320
                  0.4057400             -0.3314430
                  0.0950670              0.6577990
            S    7   1.00
                 29.2650000              0.0309420
                 18.3491000             -0.1631770
                 11.5257000              0.3100050
                  4.3859900             -0.5289420
                  0.8910800              1.2562440
                  0.4057400             -0.4970260
                  0.0950670             -1.8102840
            S    1   1.00
                  0.0358680              1.0000000
            S    1   1.00
                  0.0135000              1.0000000
            P    6   1.00
                  7.1199600              0.1786130
                  4.6018200             -0.5085500
                  2.9004600              0.1812060
                  0.9377910              0.6364370
                  0.3915000              0.4348840
                  0.1071520              0.0442170
            P    6   1.00
                  7.1199600             -0.0485910
                  4.6018200              0.1398590
                  2.9004600             -0.0462230
                  0.9377910             -0.2282940
                  0.3915000             -0.1575630
                  0.1071520              0.5288190
            P    6   1.00
                  7.1199600             -0.0658780
                  4.6018200              0.1871460
                  2.9004600             -0.0488380
                  0.9377910             -0.3615180
                  0.3915000             -0.1743340
                  0.1071520              0.9190410
            P    1   1.00
                  0.0367710              1.0000000
            P    1   1.00
                  0.0126000              1.0000000
            D    5   1.00
                  7.4982700              0.0144910
                  4.6961800             -0.0529680
                  1.0636000              0.2380440
                  0.4188210              0.4352750
                  0.1545660              0.4244200
            D    5   1.00
                  7.4982700             -0.0165460
                  4.6961800              0.0618730
                  1.0636000             -0.3167410
                  0.4188210             -0.5274120
                  0.1545660              0.3428660
            D    1   1.00
                  0.0526440              1.0000000
            D    1   1.00
                  0.0179000              1.0000000
            F    1   1.00
                  0.2700000              1.0000000
            F    1   1.00
                  0.0824000              1.0000000
            ****
            -Ta     0
            S    7   1.00
                 29.8670000              0.0287250
                 18.7203000             -0.1985810
                 11.7533000              0.4482880
                  4.5708900             -0.7983960
                  0.9478400              0.8861040
                  0.4340380              0.4136940
                  0.1050310              0.0121460
            S    7   1.00
                 29.8670000             -0.0091320
                 18.7203000              0.0630170
                 11.7533000             -0.1437480
                  4.5708900              0.2705360
                  0.9478400             -0.4015970
                  0.4340380             -0.3195670
                  0.1050310              0.6651050
            S    7   1.00
                 29.8670000              0.0324720
                 18.7203000             -0.1723550
                 11.7533000              0.3341840
                  4.5708900             -0.5725580
                  0.9478400              1.3652610
                  0.4340380             -0.6032250
                  0.1050310             -1.7315730
            S    1   1.00
                  0.0389480              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                  7.3652400              0.1796820
                  4.7544000             -0.5211000
                  2.9959500              0.1911040
                  0.9941230              0.6464550
                  0.4196000              0.4240400
                  0.1182390              0.0425600
            P    6   1.00
                  7.3652400             -0.0508780
                  4.7544000              0.1495500
                  2.9959500             -0.0507540
                  0.9941230             -0.2483790
                  0.4196000             -0.1478010
                  0.1182390              0.5415390
            P    6   1.00
                  7.3652400             -0.0697670
                  4.7544000              0.2016550
                  2.9959500             -0.0482900
                  0.9941230             -0.4247200
                  0.4196000             -0.1275720
                  0.1182390              0.9415430
            P    1   1.00
                  0.0401010              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  7.5616000              0.0178690
                  4.7408700             -0.0661360
                  1.1697500              0.2554580
                  0.4793100              0.4454920
                  0.1837040              0.4029670
            D    5   1.00
                  7.5616000             -0.0205840
                  4.7408700              0.0780240
                  1.1697500             -0.3544000
                  0.4793100             -0.5155940
                  0.1837040              0.4207610
            D    1   1.00
                  0.0644090              1.0000000
            D    1   1.00
                  0.0226000              1.0000000
            F    1   1.00
                  0.3735000              1.0000000
            F    1   1.00
                  0.1286000              1.0000000
            ****
            -W     0
            S    7   1.00
                 31.1844000              0.0268990
                 19.5385000             -0.1892380
                 12.2602000              0.4339650
                  4.7203700             -0.8043720
                  1.0095700              0.9015400
                  0.4634560              0.4101950
                  0.1137920              0.0110440
            S    7   1.00
                 31.1844000             -0.0086330
                 19.5385000              0.0609770
                 12.2602000             -0.1418640
                  4.7203700              0.2797320
                  1.0095700             -0.4285050
                  0.4634560             -0.3050150
                  0.1137920              0.6713040
            S    7   1.00
                 31.1844000              0.0314780
                 19.5385000             -0.1676990
                 12.2602000              0.3282920
                  4.7203700             -0.5865250
                  1.0095700              1.4154490
                  0.4634560             -0.6488270
                  0.1137920             -1.6892530
            S    1   1.00
                  0.0416420              1.0000000
            S    1   1.00
                  0.0152000              1.0000000
            P    6   1.00
                  7.7873800              0.1852090
                  5.0493000             -0.5283120
                  3.1860200              0.1871580
                  1.0593700              0.6560130
                  0.4491060              0.4179250
                  0.1276250              0.0409650
            P    6   1.00
                  7.7873800             -0.0535080
                  5.0493000              0.1546790
                  3.1860200             -0.0504270
                  1.0593700             -0.2604500
                  0.4491060             -0.1384050
                  0.1276250              0.5459010
            P    6   1.00
                  7.7873800             -0.0749390
                  5.0493000              0.2120220
                  3.1860200             -0.0424460
                  1.0593700             -0.4793750
                  0.4491060             -0.0766750
                  0.1276250              0.9477960
            P    1   1.00
                  0.0427440              1.0000000
            P    1   1.00
                  0.0143000              1.0000000
            D    5   1.00
                  8.3098300              0.0219490
                  5.2246300             -0.0773760
                  1.2952900              0.2632410
                  0.5397610              0.4595460
                  0.2089270              0.3922120
            D    5   1.00
                  8.3098300             -0.0263810
                  5.2246300              0.0952520
                  1.2952900             -0.3960520
                  0.5397610             -0.5079960
                  0.2089270              0.5236000
            D    1   1.00
                  0.0731130              1.0000000
            D    1   1.00
                  0.0256000              1.0000000
            F    1   1.00
                  0.4769000              1.0000000
            F    1   1.00
                  0.1768000              1.0000000
            ****
            -Re     0
            S    7   1.00
                 33.0133000              0.0221330
                 20.6658000             -0.1618310
                 12.9498000              0.3812300
                  4.7782300             -0.7875220
                  1.0858000              0.8980810
                  0.5000250              0.4224690
                  0.1210690              0.0172060
            S    7   1.00
                 33.0133000             -0.0070680
                 20.6658000              0.0530520
                 12.9498000             -0.1282310
                  4.7782300              0.2853960
                  1.0858000             -0.4487810
                  0.5000250             -0.2976680
                  0.1210690              0.6634730
            S    7   1.00
                 33.0133000              0.0274240
                 20.6658000             -0.1468310
                 12.9498000              0.2908580
                  4.7782300             -0.5801000
                  1.0858000              1.4204980
                  0.5000250             -0.6321790
                  0.1210690             -1.6875030
            S    1   1.00
                  0.0438810              1.0000000
            S    1   1.00
                  0.0159000              1.0000000
            P    6   1.00
                  8.6759800              0.1394900
                  5.6538200             -0.3569770
                  1.4063900              0.4818040
                  0.6920560              0.5117960
                  0.3163520              0.1708180
                  0.1093090              0.0097820
            P    6   1.00
                  8.6759800             -0.0412390
                  5.6538200              0.1083450
                  1.4063900             -0.1688840
                  0.6920560             -0.2386860
                  0.3163520              0.0632430
                  0.1093090              0.6102210
            P    6   1.00
                  8.6759800             -0.0651350
                  5.6538200              0.1725300
                  1.4063900             -0.2649320
                  0.6920560             -0.4743410
                  0.3163520              0.3991830
                  0.1093090              0.8030920
            P    1   1.00
                  0.0385810              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  8.6719700              0.0171910
                  5.4414200             -0.0665390
                  1.3750800              0.2711570
                  0.5838300              0.4487710
                  0.2293620              0.3778590
            D    5   1.00
                  8.6719700             -0.0203340
                  5.4414200              0.0775390
                  1.3750800             -0.3686920
                  0.5838300             -0.4745880
                  0.2293620              0.4599950
            D    1   1.00
                  0.0808850              1.0000000
            D    1   1.00
                  0.0285000              1.0000000
            F    1   1.00
                  0.5533000              1.0000000
            F    1   1.00
                  0.2126000              1.0000000
            ****
            -Os     0
            S    7   1.00
                 34.5933000              0.0194050
                 21.6442000             -0.1468750
                 13.5521000              0.3551890
                  4.8950800             -0.7883690
                  1.1634600              0.9033000
                  0.5380840              0.4302560
                  0.1306730              0.0181640
            S    7   1.00
                 34.5933000             -0.0059240
                 21.6442000              0.0475810
                 13.5521000             -0.1198590
                  4.8950800              0.2905900
                  1.1634600             -0.4633260
                  0.5380840             -0.2910580
                  0.1306730              0.6489970
            S    7   1.00
                 34.5933000              0.0286790
                 21.6442000             -0.1533520
                 13.5521000              0.3066570
                  4.8950800             -0.6590400
                  1.1634600              1.6880660
                  0.5380840             -0.9098660
                  0.1306730             -1.5178370
            S    1   1.00
                  0.0469820              1.0000000
            S    1   1.00
                  0.0169000              1.0000000
            P    6   1.00
                  9.1259400              0.1316100
                  5.8907300             -0.3487910
                  1.4397800              0.5276330
                  0.6929760              0.5000040
                  0.3084380              0.1387070
                  0.1086800              0.0055910
            P    6   1.00
                  9.1259400             -0.0379630
                  5.8907300              0.1036120
                  1.4397800             -0.1857190
                  0.6929760             -0.2213770
                  0.3084380              0.0960590
                  0.1086800              0.6029380
            P    6   1.00
                  9.1259400             -0.0676070
                  5.8907300              0.1858450
                  1.4397800             -0.3480470
                  0.6929760             -0.4511480
                  0.3084380              0.5586130
                  0.1086800              0.7068530
            P    1   1.00
                  0.0381830              1.0000000
            P    1   1.00
                  0.0134000              1.0000000
            D    5   1.00
                  9.3395000              0.0158420
                  5.8557100             -0.0635100
                  1.4647600              0.2828700
                  0.6312200              0.4507810
                  0.2506620              0.3664550
            D    5   1.00
                  9.3395000             -0.0209240
                  5.8557100              0.0807150
                  1.4647600             -0.4242800
                  0.6312200             -0.4620180
                  0.2506620              0.5555660
            D    1   1.00
                  0.0891640              1.0000000
            D    1   1.00
                  0.0317000              1.0000000
            F    1   1.00
                  0.6278000              1.0000000
            F    1   1.00
                  0.2478000              1.0000000
            ****
            -Ir     0
            S    7   1.00
                 36.0577000              0.0172890
                 22.5516000             -0.1359910
                 14.1116000              0.3386690
                  5.0447500             -0.7941690
                  1.2441700              0.9080010
                  0.5769240              0.4378070
                  0.1394660              0.0187690
            S    7   1.00
                 36.0577000             -0.0049480
                 22.5516000              0.0431240
                 14.1116000             -0.1138030
                  5.0447500              0.2953180
                  1.2441700             -0.4732180
                  0.5769240             -0.2840000
                  0.1394660              0.6351880
            S    7   1.00
                 36.0577000              0.0290550
                 22.5516000             -0.1546790
                 14.1116000              0.3116730
                  5.0447500             -0.7039290
                  1.2441700              1.8161160
                  0.5769240             -1.0291110
                  0.1394660             -1.4393180
            S    1   1.00
                  0.0497400              1.0000000
            S    1   1.00
                  0.0177000              1.0000000
            P    6   1.00
                  9.5858000              0.1256510
                  6.1408800             -0.3433060
                  1.4976000              0.5536780
                  0.7141440              0.4910420
                  0.3120660              0.1228370
                  0.1151600              0.0033780
            P    6   1.00
                  9.5858000             -0.0379390
                  6.1408800              0.1069870
                  1.4976000             -0.2083670
                  0.7141440             -0.2217720
                  0.3120660              0.1266520
                  0.1151600              0.6103680
            P    6   1.00
                  9.5858000             -0.0740030
                  6.1408800              0.2101790
                  1.4976000             -0.4612670
                  0.7141440             -0.3768670
                  0.3120660              0.6521120
                  0.1151600              0.6073860
            P    1   1.00
                  0.0412770              1.0000000
            P    1   1.00
                  0.0148000              1.0000000
            D    5   1.00
                  9.9606900              0.0154630
                  6.2430300             -0.0631200
                  1.5631700              0.2923090
                  0.6819400              0.4527480
                  0.2734460              0.3571590
            D    5   1.00
                  9.9606900             -0.0198010
                  6.2430300              0.0777020
                  1.5631700             -0.4252400
                  0.6819400             -0.4331870
                  0.2734460              0.4752470
            D    1   1.00
                  0.0980080              1.0000000
            D    1   1.00
                  0.0351000              1.0000000
            F    1   1.00
                  0.7127000              1.0000000
            F    1   1.00
                  0.2898000              1.0000000
            ****
            -Pt     0
            S    7   1.00
                 37.3750000              0.0156980
                 23.3685000             -0.1285150
                 14.6164000              0.3299960
                  5.2209620             -0.8039770
                  1.3267320              0.9127650
                  0.6163210              0.4444260
                  0.1480680              0.0192250
            S    7   1.00
                 37.3750000             -0.0041400
                 23.3685000              0.0396870
                 14.6164000             -0.1100630
                  5.2209620              0.3003960
                  1.3267320             -0.4809750
                  0.6163210             -0.2769970
                  0.1480680              0.6216130
            S    7   1.00
                 37.3750000              0.0303040
                 23.3685000             -0.1595530
                 14.6164000              0.3222870
                  5.2209620             -0.7469090
                  1.3267320              1.9183060
                  0.6163210             -1.1164460
                  0.1480680             -1.3836520
            S    1   1.00
                  0.0523910              1.0000000
            S    1   1.00
                  0.0185000              1.0000000
            P    6   1.00
                  9.9926800              0.1240460
                  6.3831700             -0.3446320
                  1.5696500              0.5711200
                  0.7427790              0.4873560
                  0.3180200              0.1119590
                  0.1141460              0.0019280
            P    6   1.00
                  9.9926800             -0.0346870
                  6.3831700              0.0999320
                  1.5696500             -0.2018840
                  0.7427790             -0.1984590
                  0.3180200              0.1230340
                  0.1141460              0.5955770
            P    6   1.00
                  9.9926800             -0.0771530
                  6.3831700              0.2234940
                  1.5696500             -0.5228040
                  0.7427790             -0.3298980
                  0.3180200              0.7297730
                  0.1141460              0.5372880
            P    1   1.00
                  0.0398630              1.0000000
            P    1   1.00
                  0.0139000              1.0000000
            D    5   1.00
                 10.4126000              0.0150800
                  6.5226600             -0.0622950
                  1.6643000              0.3006490
                  0.7342080              0.4539610
                  0.2974070              0.3490010
            D    5   1.00
                 10.4126000             -0.0198660
                  6.5226600              0.0796630
                  1.6643000             -0.4687940
                  0.7342080             -0.4051740
                  0.2974070              0.5192890
            D    1   1.00
                  0.1075990              1.0000000
            D    1   1.00
                  0.0389000              1.0000000
            F    1   1.00
                  0.8018000              1.0000000
            F    1   1.00
                  0.3357000              1.0000000
            ****
            -Au     0
            S    8   1.00
                 38.0008000              0.0200090
                 23.9725000             -0.1516790
                 15.2182000              0.3639600
                  5.5399900             -0.8213260
                  1.3855100              0.9366410
                  0.6424610              0.4235270
                  0.1564960              0.0162500
                  0.0549100             -0.0009780
            S    8   1.00
                 38.0008000             -0.0053040
                 23.9725000              0.0463180
                 15.2182000             -0.1199400
                  5.5399900              0.3040620
                  1.3855100             -0.4945010
                  0.6424610             -0.2555160
                  0.1564960              0.6091630
                  0.0549100              0.5977670
            S    8   1.00
                 38.0008000              0.0323400
                 23.9725000             -0.1717620
                 15.2182000              0.3395030
                  5.5399900             -0.7461790
                  1.3855100              1.9174980
                  0.6424610             -1.1299310
                  0.1564960             -1.3662840
                  0.0549100              1.4423910
            S    1   1.00
                  0.0549100              1.0000000
            S    1   1.00
                  0.0193000              1.0000000
            P    7   1.00
                 10.3092000              0.1282170
                  6.6276500             -0.3537900
                  1.6744700              0.5662110
                  0.8011160              0.4931710
                  0.3468790              0.1137750
                  0.1227010              0.0025340
                  0.0424280              0.0006790
            P    7   1.00
                 10.3092000             -0.0358850
                  6.6276500              0.1028900
                  1.6744700             -0.2009880
                  0.8011160             -0.2010450
                  0.3468790              0.1165490
                  0.1227010              0.5949690
                  0.0424280              0.4555200
            P    7   1.00
                 10.3092000             -0.0772420
                  6.6276500              0.2226110
                  1.6744700             -0.4953530
                  0.8011160             -0.3607470
                  0.3468790              0.7100000
                  0.1227010              0.5688390
                  0.0424280              0.0011930
            P    1   1.00
                  0.0424280              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.0027000              0.0164670
                  6.8916600             -0.0680130
                  1.8080800              0.2994920
                  0.8210510              0.4543030
                  0.3441610              0.3442240
                  0.1297430              0.1212560
            D    6   1.00
                 11.0027000             -0.0236280
                  6.8916600              0.0956720
                  1.8080800             -0.5412940
                  0.8210510             -0.3955330
                  0.3441610              0.6191650
                  0.1297430              0.4682760
            D    1   1.00
                  0.1297430              1.0000000
            D    1   1.00
                  0.0489000              1.0000000
            F    1   1.00
                  0.8919000              1.0000000
            F    1   1.00
                  0.3789000              1.0000000
            ****
            -Hg     0
            S    8   1.00
                 41.4804000              0.0100720
                 22.5328000             -0.1147810
                 14.0790000              0.3564080
                  5.7247400             -0.8484430
                  1.4794800              0.9405960
                  0.6882660              0.4353290
                  0.1641810              0.0131780
                  0.0572230             -0.0023140
            S    8   1.00
                 41.4804000              0.0020320
                 22.5328000             -0.0323140
                 14.0790000              0.1153500
                  5.7247400             -0.3177630
                  1.4794800              0.5135230
                  0.6882660              0.2500500
                  0.1641810             -0.6488410
                  0.0572230             -0.5599430
            S    8   1.00
                 41.4804000              0.0218280
                 22.5328000             -0.1555640
                 14.0790000              0.3860250
                  5.7247400             -0.8961040
                  1.4794800              2.3321950
                  0.6882660             -1.5976600
                  0.1641810             -1.0536460
                  0.0572230              1.2895360
            S    1   1.00
                  0.0572230              1.0000000
            S    1   1.00
                  0.0199000              1.0000000
            P    7   1.00
                 10.5805000              0.1286920
                  6.8053900             -0.3608420
                  1.7901600              0.5641170
                  0.8622610              0.5002740
                  0.3752770              0.1137850
                  0.1284210              0.0029390
                  0.0434470              0.0004880
            P    7   1.00
                 10.5805000             -0.0344430
                  6.8053900              0.1009290
                  1.7901600             -0.1924390
                  0.8622610             -0.1960690
                  0.3752770              0.1042040
                  0.1284210              0.5873870
                  0.0434470              0.4727830
            P    7   1.00
                 10.5805000              0.0714680
                  6.8053900             -0.2108590
                  1.7901600              0.4452040
                  0.8622610              0.3916080
                  0.3752770             -0.6670830
                  0.1284210             -0.6195740
                  0.0434470             -0.0009090
            P    1   1.00
                  0.0434470              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.5841000              0.0167290
                  7.2487900             -0.0695580
                  1.9366200              0.3034370
                  0.8987480              0.4548780
                  0.3869310              0.3368080
                  0.1504660              0.1130160
            D    6   1.00
                 11.5841000             -0.0249840
                  7.2487900              0.1041030
                  1.9366200             -0.6169860
                  0.8987480             -0.3538260
                  0.3869310              0.6872800
                  0.1504660              0.3930900
            D    1   1.00
                  0.1504660              1.0000000
            D    1   1.00
                  0.0585000              1.0000000
            F    1   1.00
                  0.9974000              1.0000000
            F    1   1.00
                  0.4377000              1.0000000
            ****
            -Tl     0
            S    8   1.00
                 36.1096000              0.0229790
                 22.5732000             -0.1728970
                 14.1144000              0.4807030
                  6.1597600             -0.9532140
                  1.5706900              0.9608670
                  0.7459610              0.4319720
                  0.1958840              0.0131990
                  0.0710030             -0.0021060
            S    8   1.00
                 36.1096000              0.0059010
                 22.5732000             -0.0544410
                 14.1144000              0.1709120
                  6.1597600             -0.3868060
                  1.5706900              0.5717530
                  0.7459610              0.2895580
                  0.1958840             -0.7163850
                  0.0710030             -0.5289600
            S    1   1.00
                  0.1958840              1.0000000
            S    1   1.00
                  0.0710030              1.0000000
            S    1   1.00
                  0.0206000              1.0000000
            P    6   1.00
                 10.3856000              0.1621170
                  7.0093900             -0.4046950
                  1.7768800              0.6949780
                  0.7479420              0.4664960
                  0.1768080              0.0280130
                  0.0515320             -0.0041730
            P    6   1.00
                 10.3856000             -0.0391990
                  7.0093900              0.1017260
                  1.7768800             -0.2199420
                  0.7479420             -0.1194500
                  0.1768080              0.4597680
                  0.0515320              0.6763890
            P    1   1.00
                  0.0515320              1.0000000
            P    1   1.00
                  0.0130000              1.0000000
            D    6   1.00
                 10.9087000              0.0217120
                  6.8364900             -0.0832690
                  1.9974900              0.3418070
                  0.9144720              0.4833160
                  0.3895180              0.3047550
                  0.1501000              0.0649830
            D    1   1.00
                  0.1501000              1.0000000
            D    1   1.00
                  0.0437000              1.0000000
            ****
            -Pb     0
            S    8   1.00
                 37.4583000              0.0248240
                 23.3170000             -0.1810620
                 14.5759000              0.5007060
                  6.4337600             -0.9797370
                  1.6671900              0.9666300
                  0.8077320              0.4364870
                  0.2270840              0.0136860
                  0.0842520             -0.0020210
            S    8   1.00
                 37.4583000              0.0067850
                 23.3170000             -0.0601870
                 14.5759000              0.1889710
                  6.4337600             -0.4248380
                  1.6671900              0.6220350
                  0.8077320              0.3160880
                  0.2270840             -0.7594740
                  0.0842520             -0.5151310
            S    1   1.00
                  0.2270840              1.0000000
            S    1   1.00
                  0.0842520              1.0000000
            S    1   1.00
                  0.0278000              1.0000000
            P    6   1.00
                 10.6186000              0.1701740
                  7.1878100             -0.4241790
                  1.8943900              0.6934430
                  0.8167090              0.4737730
                  0.2036880              0.0290470
                  0.0649730             -0.0043860
            P    6   1.00
                 10.6186000             -0.0479540
                  7.1878100              0.1245560
                  1.8943900             -0.2597760
                  0.8167090             -0.1414800
                  0.2036880              0.5317690
                  0.0649730              0.6087590
            P    1   1.00
                  0.0649730              1.0000000
            P    1   1.00
                  0.0197000              1.0000000
            D    6   1.00
                 13.7266000              0.0107870
                  6.9898300             -0.0666500
                  2.1735200              0.3342590
                  1.0281200              0.4826840
                  0.4558570              0.3004140
                  0.1822000              0.0632580
            D    1   1.00
                  0.1822000              1.0000000
            D    1   1.00
                  0.0609000              1.0000000
            ****
            -Bi     0
            S    8   1.00
                211.8210000              0.0010880
                 21.3262000             -0.1058620
                 13.3654000              0.5308080
                  6.9461000             -1.0502650
                  1.7122900              0.9958560
                  0.8391070              0.3989520
                  0.2553640              0.0117780
                  0.0967000             -0.0014700
            S    8   1.00
                211.8210000              0.0004220
                 21.3262000             -0.0385370
                 13.3654000              0.2172380
                  6.9461000             -0.4810970
                  1.7122900              0.7015950
                  0.8391070              0.2905200
                  0.2553640             -0.7997780
                  0.0967000             -0.4961310
            S    1   1.00
                  0.2553640              1.0000000
            S    1   1.00
                  0.0967000              1.0000000
            S    1   1.00
                  0.0317000              1.0000000
            P    6   1.00
                 11.0644000              0.1672490
                  7.4500000             -0.4252620
                  2.0106900              0.6925250
                  0.8883210              0.4753740
                  0.2363690              0.0298590
                  0.0792900             -0.0044930
            P    6   1.00
                 11.0644000             -0.0522010
                  7.4500000              0.1390830
                  2.0106900             -0.2935560
                  0.8883210             -0.1585740
                  0.2363690              0.5743620
                  0.0792900              0.5726780
            P    1   1.00
                  0.0792900              1.0000000
            P    1   1.00
                  0.0254000              1.0000000
            D    6   1.00
                 16.2461000              0.0078080
                  6.9836300             -0.0668310
                  2.3747600              0.3241400
                  1.1537200              0.4858310
                  0.5259740              0.3010560
                  0.2151000              0.0631960
            D    1   1.00
                  0.2151000              1.0000000
            D    1   1.00
                  0.0745000              1.0000000
            ****
            -Po     0
            S    8   1.00
                295.3900000              0.0013830
                 21.2683000             -0.1050610
                 13.3379000              0.5914250
                  7.3652100             -1.1156970
                  1.7892000              1.0191620
                  0.8849940              0.3798790
                  0.2857870              0.0107810
                  0.1093240             -0.0011440
            S    8   1.00
                295.3900000              0.0006830
                 21.2683000             -0.0385730
                 13.3379000              0.2519580
                  7.3652100             -0.5330160
                  1.7892000              0.7669010
                  0.8849940              0.2818780
                  0.2857870             -0.8394770
                  0.1093240             -0.4792720
            S    1   1.00
                  0.2857870              1.0000000
            S    1   1.00
                  0.1093240              1.0000000
            S    1   1.00
                  0.0359000              1.0000000
            P    6   1.00
                 11.5069000              0.1663640
                  7.7299100             -0.4272350
                  2.1189400              0.6969640
                  0.9553230              0.4713590
                  0.2683520              0.0299870
                  0.0884940             -0.0034870
            P    6   1.00
                 11.5069000             -0.0559100
                  7.7299100              0.1511230
                  2.1189400             -0.3261600
                  0.9553230             -0.1614090
                  0.2683520              0.6016150
                  0.0884940              0.5559720
            P    1   1.00
                  0.0884940              1.0000000
            P    1   1.00
                  0.0278000              1.0000000
            D    6   1.00
                 18.7130000              0.0066940
                  7.0570800             -0.0671040
                  2.5506200              0.3257980
                  1.2506900              0.4957630
                  0.5742560              0.2931060
                  0.2330000              0.0541620
            D    1   1.00
                  0.2330000              1.0000000
            D    1   1.00
                  0.0895000              1.0000000
            ****
            -At     0
            S    8   1.00
                304.0310000              0.0010310
                 22.4085000             -0.1018690
                 14.0490000              0.5632730
                  7.5895000             -1.1045120
                  1.8949400              1.0263640
                  0.9523580              0.3833240
                  0.3170410              0.0113590
                  0.1224900             -0.0011400
            S    8   1.00
                304.0310000              0.0004960
                 22.4085000             -0.0387430
                 14.0490000              0.2490070
                  7.5895000             -0.5516910
                  1.8949400              0.8155580
                  0.9523580              0.2868020
                  0.3170410             -0.8682780
                  0.1224900             -0.4694960
            S    1   1.00
                  0.3170410              1.0000000
            S    1   1.00
                  0.1224900              1.0000000
            S    1   1.00
                  0.0404000              1.0000000
            P    6   1.00
                 12.0093000              0.1631810
                  8.0330000             -0.4244130
                  2.2239300              0.7031340
                  1.0213300              0.4641680
                  0.3012660              0.0302600
                  0.0999030             -0.0026180
            P    6   1.00
                 12.0093000             -0.0583630
                  8.0330000              0.1606310
                  2.2239300             -0.3589420
                  1.0213300             -0.1621230
                  0.3012660              0.6248880
                  0.0999030              0.5397840
            P    1   1.00
                  0.0999030              1.0000000
            P    1   1.00
                  0.0313000              1.0000000
            D    6   1.00
                 21.3084000              0.0061410
                  7.0207600             -0.0706690
                  2.7689800              0.3190200
                  1.3731400              0.5044700
                  0.6368040              0.2924810
                  0.2593000              0.0514950
            D    1   1.00
                  0.2593000              1.0000000
            D    1   1.00
                  0.1073000              1.0000000
            ****
            -Rn     0
            S    8   1.00
                383.5850000              0.0015720
                 23.2936000             -0.0761810
                 14.6096000              0.4785080
                  7.7319900             -1.0439020
                  1.9942400              1.0190710
                  1.0240700              0.3914520
                  0.3454220              0.0127820
                  0.1350810             -0.0012970
            S    8   1.00
                383.5850000              0.0009020
                 23.2936000             -0.0265350
                 14.6096000              0.2148510
                  7.7319900             -0.5453780
                  1.9942400              0.8694020
                  1.0240700              0.2728620
                  0.3454220             -0.8929670
                  0.1350810             -0.4539150
            S    1   1.00
                  0.3454220              1.0000000
            S    1   1.00
                  0.1350810              1.0000000
            S    1   1.00
                  0.0449000              1.0000000
            P    6   1.00
                 12.4992000              0.1629940
                  8.3397600             -0.4262290
                  2.3359100              0.7107760
                  1.0901900              0.4580860
                  0.3348980              0.0292130
                  0.1125460             -0.0031070
            P    6   1.00
                 12.4992000             -0.0609340
                  8.3397600              0.1694830
                  2.3359100             -0.3880550
                  1.0901900             -0.1612760
                  0.3348980              0.6446740
                  0.1125460              0.5255260
            P    1   1.00
                  0.1125460              1.0000000
            P    1   1.00
                  0.0348000              1.0000000
            D    6   1.00
                 24.1705000              0.0058780
                  6.9459900             -0.0765200
                  3.0380900              0.3071660
                  1.5168400              0.5141680
                  0.7091570              0.2972850
                  0.2888000              0.0512000
            D    1   1.00
                  0.2888000              1.0000000
            D    1   1.00
                  0.1251000              1.0000000
            ****
            
            -Y     0
            Y-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      7.85827500           135.13497400
            2      3.38212800            15.41163200
            p-g potential
              4
            2      6.84979100            29.25143700
            2      6.71009200            58.50836300
            2      3.04215900             3.78024300
            2      2.93733000             7.67654700
            d-g potential
              4
            2      5.41631500            11.84991100
            2      5.33341600            17.77810300
            2      1.97621200             2.06238300
            2      1.96111100             3.07565000
            f-g potential
              2
            2      5.02859000            -6.92807800
            2      5.00558200            -9.15509900
            -ZR     0
            ZR-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      8.63652800           150.24299400
            2      3.71763900            18.78003600
            p-g potential
              4
            2      7.62672800            33.19279100
            2      7.45320700            66.38903900
            2      3.35838900             4.62072600
            2      3.22973800             9.26027000
            d-g potential
              4
            2      5.93808600            13.99338300
            2      5.82554400            20.99588200
            2      2.20501900             2.28516600
            2      2.20629200             3.44126000
            f-g potential
              2
            2      4.80021500            -5.23932000
            2      4.79899200            -6.98742400
            -NB     0
            NB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      9.37657800           165.15673600
            2      4.04357200            21.82395100
            p-g potential
              4
            2      8.36360900            37.24928400
            2      8.16689800            74.50738900
            2      3.69307500             5.43948600
            2      3.55104700            10.91325200
            d-g potential
              4
            2      6.68910800            15.21454900
            2      6.53719300            22.83350800
            2      2.55111800             3.00005200
            2      2.56789600             4.55373400
            f-g potential
              2
            2      5.56828500            -6.28135400
            2      5.67137200            -8.75564400
            -MO     0
            MO-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.09700000           180.07685300
            2      4.37567000            24.71592000
            p-g potential
              4
            2      9.12656400            41.22767800
            2      8.86322300            82.45267000
            2      4.04494800             6.34509200
            2      3.86665700            12.45842300
            d-g potential
              4
            2      7.53575400            19.30874400
            2      7.27897600            28.97767400
            2      2.76320500             3.18951600
            2      2.77208500             4.70016900
            f-g potential
              2
            2      6.30663300            -7.17888800
            2      6.35644800            -9.74597800
            -TC     0
            TC-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.79936900           195.09130300
            2      4.70725700            27.34041300
            p-g potential
              4
            2      9.82669900            45.06081200
            2      9.56111500            90.11729500
            2      4.37857800             7.07051700
            2      4.19090700            14.04801900
            d-g potential
              4
            2      8.33604500            21.65775500
            2      8.24453300            32.47195900
            2      3.09370700             3.78952500
            2      3.16872200             6.05343000
            f-g potential
              2
            2      7.04094000            -7.99562300
            2      7.06947300           -10.74569600
            -RU     0
            RU-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     11.50059000           209.78649300
            2      5.06857500            30.21430700
            p-g potential
              4
            2     10.53263400            48.75124400
            2     10.19201000            97.49652900
            2      4.73489200             7.86018800
            2      4.50906500            15.32975100
            d-g potential
              4
            2      8.87797700            26.96750600
            2      8.76612200            40.43230300
            2      3.17019600             3.34075800
            2      3.22885100             5.25635200
            f-g potential
              2
            2      7.82024900            -8.84752500
            2      7.83964700           -11.83551800
            -RH     0
            RH-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.19481600           225.31205400
            2      5.40513700            32.44158200
            p-g potential
              4
            2     11.28075500            52.87282600
            2     10.92724800           105.74552600
            2      5.09011700             8.61934400
            2      4.85183200            16.97345900
            d-g potential
              4
            2      9.13633700            25.10850100
            2      8.96480800            37.69573100
            2      3.64361200             4.20258400
            2      3.63600700             6.29279000
            f-g potential
              2
            2      8.61622800            -9.67356800
            2      8.62943500           -12.89984700
            -PD     0
            PD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.79882500           240.26278900
            2      5.80052800            34.72996100
            p-g potential
              4
            2     11.87469700            56.74692900
            2     11.47433500           113.44441700
            2      5.51599900             9.34563900
            2      5.24804300            18.34544700
            d-g potential
              4
            2      8.50221200            28.59555400
            2      7.98332400            43.45392100
            2      3.10762800             1.85228600
            2      2.47673400             1.40676500
            f-g potential
              2
            2      9.67957100           -10.98725500
            2      9.69134900           -14.62619000
            -AG     0
            AG-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.5677140            255.0547710
            2      6.9976620             36.9833930
            p-g potential
              4
            2     11.3164960             60.7157050
            2     10.9580630            121.4438890
            2      7.1114000             10.1718660
            2      6.7733190             20.4865640
            d-g potential
              4
            2      8.9284370             29.5049380
            2     11.1025670             44.0187360
            2      5.5432120              5.3683330
            2      3.9288350              7.4083750
            f-g potential
              2
            2     11.0129130            -12.6234030
            2     11.0198980            -16.7643270
            -CD     0
            CD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     13.3551760            270.0394480
            2      7.3083780             38.8777660
            p-g potential
              4
            2     12.6597280             64.6074700
            2     12.2896390            129.2194450
            2      6.7861760             10.6225580
            2      6.4007430             21.2650460
            d-g potential
              4
            2     11.1617220             31.6639650
            2     11.2196150             47.4892160
            2      4.5377330              5.1862000
            2      4.3357270              7.5660630
            f-g potential
              2
            2     11.4789860            -12.6327850
            2     11.4870270            -16.7601710
            -IN     0
            IN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     15.3928220            281.1223500
            2      8.0558640             61.9014700
            p-g potential
              4
            2     13.9286720             67.4621540
            2     13.3472340            134.9492500
            2      7.6141320             14.7461400
            2      7.3183650             29.6392620
            d-g potential
              4
            2     14.0347150             35.4932540
            2     14.5116160             53.1787730
            2      5.5505500              9.1772810
            2      5.0594150             12.3924100
            f-g potential
              2
            2     12.5390560            -13.7280780
            2     12.5525610            -18.2068660
            -SN     0
            SN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     17.4204140            279.9886820
            2      7.6311550             62.3778100
            p-g potential
              4
            2     16.1310240             66.1625230
            2     15.6280770            132.1743960
            2      7.3256080             16.3394170
            2      6.9425190             32.4889590
            d-g potential
              4
            2     15.5149760             36.3874410
            2     15.1881600             54.5078410
            2      5.4560240              8.6968230
            2      5.3631050             12.8402080
            f-g potential
              2
            2     12.2823480            -12.5763330
            2     12.2721500            -16.5959440
            -SB     0
            SB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.3308650            281.0715810
            2      8.5565420             61.7166040
            p-g potential
              4
            2     14.4703370             67.4573800
            2     13.8161940            134.9335030
            2      8.4249240             14.7163440
            2      8.0927280             29.5185120
            d-g potential
              4
            2     14.8863310             35.4478150
            2     15.1463190             53.1434660
            2      5.9082670              9.1792230
            2      5.5943220             13.2402530
            f-g potential
              2
            2     14.4449780            -15.3668010
            2     14.4492950            -20.2961380
            -TE     0
            TE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.8144730            281.0458430
            2      8.7935260             61.6206560
            p-g potential
              4
            2     14.8778010             67.4494640
            2     14.2697310            134.9043040
            2      8.7244350             14.6895470
            2      8.2915150             29.4150630
            d-g potential
              4
            2     15.2050080             35.4320570
            2     15.2258480             53.1356870
            2      6.0717690              9.0698020
            2      5.8047600             13.1223040
            f-g potential
              2
            2     15.2061680            -15.7454500
            2     15.2017020            -20.7424480
            -I     0
            I-ECP     4     28
            g potential
              1
            2      1.00000000             0.00000000
            s-g potential
              3
            2     40.03337600            49.98964900
            2     17.30057600           281.00655600
            2      8.85172000            61.41673900
            p-g potential
              4
            2     15.72014100            67.41623900
            2     15.20822200           134.80769600
            2      8.29418600            14.56654800
            2      7.75394900            28.96842200
            d-g potential
              4
            2     13.81775100            35.53875600
            2     13.58780500            53.33975900
            2      6.94763000             9.71646600
            2      6.96009900            14.97750000
            f-g potential
              4
            2     18.52295000           -20.17661800
            2     18.25103500           -26.08807700
            2      7.55790100            -0.22043400
            2      7.59740400            -0.22164600
            -XE     0
            XE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              3
            2     40.0051840             49.9979620
            2     17.8122140            281.0133030
            2      9.3041500             61.5382550
            p-g potential
              4
            2     15.7017720             67.4391420
            2     15.2586080            134.8747110
            2      9.2921840             14.6633000
            2      8.5590030             29.3547300
            d-g potential
              6
            2     15.1856000             35.4369080
            2     14.2845000             53.1957720
            2      7.1218890              9.0462320
            2      6.9919630             13.2236810
            2      0.6239460              0.0848530
            2      0.6472840              0.0441550
            f-g potential
              4
            2     20.8815570            -23.0892950
            2     20.7834430            -30.0744750
            2      5.2533890             -0.2882270
            2      5.3611880             -0.3869240
            -HF     0
            HF-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.24885600           478.23740400
            4     10.72912700             0.38802400
            2      1.96485600            -1.07123200
            p-h potential
              6
            2      8.68346200           101.04681800
            2      7.91692000           212.19776100
            4      9.37924300             0.13264600
            4      8.24420900             0.45310800
            2      1.59668600            -0.40791400
            2      1.71028100            -0.56181700
            d-h potential
              6
            2      5.18955700            43.11546700
            2      5.25322900            65.93473200
            4      5.93787100             0.02591200
            4      5.71290600             0.03374100
            2      1.01485600            -0.28057900
            2      0.47371200            -0.08484900
            f-h potential
              2
            2      1.91260800             4.81180100
            2      1.88074000             6.41857400
            g-h potential
              2
            2      2.72418000            -4.63658500
            2      2.70895300            -5.76728800
            -TA     0
            TA-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.31806900           454.60064900
            4     10.54026700             2.83797500
            2      2.57472600            -0.81473600
            p-h potential
              6
            2      8.74334200            96.91078300
            2      7.91622300           195.85043200
            4      9.27573600             4.81252400
            4      8.10167500             6.33851200
            2      2.07712700            -0.45917300
            2      2.75037200            -0.64458600
            d-h potential
              6
            2      5.44731400            45.96997600
            2      5.21254500            69.63897200
            4      5.88435800             0.80293300
            4      5.64957900             0.42959500
            2      1.38818000            -0.30722700
            2      1.29439800            -0.46156000
            f-h potential
              2
            2      2.16127500             5.75777300
            2      2.12593900             7.67816700
            g-h potential
              2
            2      3.14592000            -5.68406600
            2      3.12794200            -7.06231300
            -W     0
            W-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     11.06379500           419.22759900
            2      8.21764100            41.19130700
            p-h potential
              6
            2      9.33818800           107.34811000
            2      8.43044800           214.69956800
            4      9.49002000             0.02544200
            4      9.48994700             0.05189500
            2      1.88299700            -0.11718400
            2      1.90697200             0.29668900
            d-h potential
              6
            2      6.20543300            58.88127900
            2      6.12215700            98.68355600
            4      6.27455600             0.01953700
            4      6.22637500             0.02195600
            2      1.96387500            -0.08857700
            2      1.88828700            -0.20972600
            f-h potential
              2
            2      2.30795300             6.23247200
            2      2.27060900             8.31134500
            g-h potential
              2
            2      3.58349100            -6.80294400
            2      3.56251500            -8.44323200
            -RE     0
            RE-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     12.16381400           421.97030000
            2      7.10759500            50.13443900
            p-h potential
              4
            2      9.68459700            88.48191000
            2      9.47621400           176.78722000
            2      7.66806600            10.43433800
            2      5.05515600            20.45874300
            d-h potential
              4
            2      6.50988800            43.16243100
            2      6.09121600            64.76775900
            2      4.16400600             5.34030100
            2      4.40737900             8.24333200
            f-h potential
              2
            2      2.56265800             7.24454300
            2      2.52154900             9.65926600
            g-h potential
              2
            2      4.03459900            -7.97494000
            2      4.00962800            -9.88273600
            -OS     0
            OS-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.00200100           424.39037600
            2      6.96276300            57.12250300
            p-h potential
              4
            2     10.49894100            88.27900300
            2      9.99252300           176.48606400
            2      6.58824800            11.71501200
            2      5.03716700            22.91500600
            d-h potential
              4
            2      7.08344100            44.77770800
            2      6.72117900            67.15364800
            2      3.79462600             5.55038700
            2      3.74812500             8.22010400
            f-h potential
              2
            2      2.82627600             8.32833200
            2      2.78119800            11.10310200
            g-h potential
              2
            2      4.49698100            -9.18134300
            2      4.46773800           -11.36160400
            -IR     0
            IR-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.83147400           426.95814900
            2      7.04791400            65.33881300
            p-h potential
              4
            2     11.10643300            88.07544200
            2     10.45655200           176.12477000
            2      6.37961400            12.68226000
            2      5.06472600            24.63594900
            d-h potential
              4
            2      7.54875400            46.43325800
            2      7.26530800            69.63807400
            2      3.80096900             6.15024800
            2      3.71828000             9.46356000
            f-h potential
              2
            2      3.09870600             9.48361000
            2      3.04946100            12.64274200
            g-h potential
              2
            2      4.96979000           -10.41069700
            2      4.93561400           -12.86319600
            -PT     0
            PT-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     14.60450000           429.64608700
            2      7.21828700            73.15688400
            p-h potential
              4
            2     11.57716200            88.02291700
            2     10.88384300           175.99819600
            2      6.42440300            13.68227400
            2      5.22419800            27.41465100
            d-h potential
              4
            2      7.69961000            43.55785200
            2      7.55080800            65.36910800
            2      3.96116400             7.01859600
            2      3.87277700            11.39173300
            f-h potential
              2
            2      3.37986900            10.71022000
            2      3.32625500            14.27812500
            g-h potential
              2
            2      5.45202000           -11.65174900
            2      5.41258500           -14.37552500
            -AU     0
            AU-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.5232180            426.6418670
            2      6.2643840             36.8006680
            p-h potential
              4
            2     11.4138670             87.0020910
            2     10.3292150            174.0043700
            2      5.7074240              8.8706100
            2      4.8281650             17.9024380
            d-h potential
              4
            2      7.4309630             49.8836550
            2      8.3219900             74.6845490
            2      4.6096420              6.4862270
            2      3.5115070              9.5468210
            f-h potential
              2
            2      3.0846390              8.7916400
            2      3.0247430             11.6584560
            g-h potential
              2
            2      3.9784420             -5.2343370
            2      4.0114910             -6.7381420
            -HG     0
            HG-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.4130710            275.7747970
            2      6.8979130             49.2678980
            p-h potential
              4
            2     11.3103200             80.5069840
            2     10.2107730            161.0348240
            2      5.9398040              9.0834160
            2      5.0197550             18.3677730
            d-h potential
              4
            2      8.4078950             51.1372560
            2      8.2140860             76.7074590
            2      4.0126120              6.5618210
            2      3.7953980              9.8180700
            f-h potential
              2
            2      3.2731060              9.4290010
            2      3.2083210             12.4948560
            g-h potential
              2
            2      4.4852960             -6.3384140
            2      4.5132000             -8.0998630
            -TL     0
            TL-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.1678050            281.2846630
            2      8.2949090             62.4342510
            p-h potential
              4
            2      7.1514920              4.6334080
            2      5.1728650              9.3417560
            2      9.8910720             72.2992530
            2      9.0033910            144.5580370
            d-h potential
              4
            2      7.1302180             35.9430390
            2      6.9269060             53.9095930
            2      5.4175700             10.3819390
            2      5.1386810             15.5838220
            f-h potential
              4
            2      5.6263990             15.8254880
            2      5.5489520             21.1040210
            2      2.8749460              2.9151270
            2      2.8214510              3.8969030
            g-h potential
              4
            2      6.6790570             -7.4945340
            2      6.7068350             -9.5405750
            2      7.2092840             -7.7979920
            2      7.0709640             -9.2595240
            -PB     0
            PB-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.2963030            281.2854990
            2      8.6326340             62.5202170
            p-h potential
              4
            2     10.2417900             72.2768970
            2      8.9241760            144.5910830
            2      6.5813420              4.7586930
            2      6.2554030              9.9406210
            d-h potential
              4
            2      7.7543360             35.8485070
            2      7.7202810             53.7243420
            2      4.9702640             10.1152560
            2      4.5637890             14.8337310
            f-h potential
              2
            2      3.8875120             12.2098920
            2      3.8119630             16.1902910
            g-h potential
              2
            2      5.6915770             -9.0966650
            2      5.7155670            -11.5319960
            -BI     0
            BI-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.0430900            283.2642270
            2      8.2216820             62.4719590
            p-h potential
              4
            2     10.4677770             72.0014990
            2      9.1189010            144.0022770
            2      6.7547910              5.0079450
            2      6.2525920              9.9915500
            d-h potential
              4
            2      8.0814740             36.3962590
            2      7.8905950             54.5976640
            2      4.9555560              9.9842940
            2      4.7045590             14.9814850
            f-h potential
              2
            2      4.2145460             13.7133830
            2      4.1334000             18.1943080
            g-h potential
              2
            2      6.2057090            -10.2474430
            2      6.2277820            -12.9557100
            -PO     0
            PO-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.2772270            283.2447060
            2      8.3995180             62.3964610
            p-h potential
              4
            2     10.6656820             71.9917160
            2      9.2837530            143.9718710
            2      6.8727490              4.9496150
            2      6.3261500              9.7404990
            d-h potential
              4
            2      8.2148660             36.3783830
            2      8.0086960             54.5627150
            2      5.0552270              9.8894990
            2      4.7825530             14.6938770
            f-h potential
              4
            2      5.0132700             17.4282950
            2      4.9846400             23.3803530
            2      1.3267600              0.1633920
            2      1.5287580              0.3245660
            g-h potential
              2
            2      6.7715260            -11.5632940
            2      6.7779250            -14.5097880
            -AT     0
            AT-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.2008320             49.9571580
            2     13.6123060            283.2103710
            2      8.5293400             62.2810520
            p-h potential
              4
            2     10.8540650             71.9823710
            2      9.4682290            143.9035320
            2      7.0311140              4.8717590
            2      6.1438580              8.9830590
            d-h potential
              4
            2      8.3135150             36.3632370
            2      7.9989650             54.5489700
            2      5.1799660              9.7762850
            2      4.9422260             14.2647550
            f-h potential
              4
            2      5.8121630             19.8701980
            2      5.7537150             26.4164520
            2      2.5134720              0.9949700
            2      2.5362610              1.4907010
            g-h potential
              4
            2      9.8957780            -22.2232030
            2      9.7373340            -26.7154760
            2      3.0133310             -0.3730440
            2      3.0977630             -0.4859460
            -RN     0
            RN-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.1512420             49.9655510
            2     14.5212410            283.0700000
            2      8.0520380             62.0028700
            p-h potential
              4
            2     11.0099420             71.9691190
            2      9.6176250            143.8605590
            2      7.3360080              4.7147610
            2      6.4062530              9.0130650
            d-h potential
              4
            2      8.3692200             36.3683650
            2      8.1169750             54.5517610
            2      5.3536560              9.6344870
            2      5.0972120             14.3879020
            f-h potential
              4
            2      6.3485710             21.7972900
            2      6.2959490             28.9468050
            2      2.8821180              1.4473650
            2      2.9080480              2.1779640
            g-h potential
              4
            2     11.0152050            -25.2280950
            2     10.9098530            -30.5661210
            2      3.4827610             -0.5748000
            2      3.6004180             -0.7795380
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/B3LYPDBJ_augccpVDZ/36b_RhEn3-lel2ob_STD/Gau-21697.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/B3LYPDBJ_augccpVDZ/36b_RhEn3-lel2ob_STD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     21699.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                 8-Jul-2021 
 ******************************************
 %NoSave
 %nproc=16
 Will use up to   16 processors via shared memory.
 %mem=80GB
 %chk=36b_RhEn3-lel2ob_STD_B3LYPDBJ-augccpVDZr
 ----------------------------------------------------------------------
 #P B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(NoS
 ymm,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq Pseudo=Rea
 d
 ----------------------------------------------------------------------
 1/29=2,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,16=1,17=8,25=1,30=1,36=2,74=-5,75=-5,116=-2,124=41/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Thu Jul  8 19:22:28 2021, MaxMem= 10737418240 cpu:               2.1 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 -----------------
 ROA calculations.
 -----------------
 Structure from the checkpoint file:  "36b_RhEn3-lel2ob_STD_B3LYPDBJ-augccpVDZr.chk"
 Charge =  3 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                -2.549130000000     -1.314427000000     -0.788263000000
  C                                                -2.489211000000     -1.476014000000      0.711136000000
  N                                                -1.044481000000     -1.454430000000      1.136257000000
  Rh                                               -0.000130000000      0.001194000000     -0.000069000000
  N                                                 0.979011000000     -1.499359000000     -1.135079000000
  C                                                 2.421772000000     -1.582914000000     -0.710906000000
  C                                                 2.489662000000     -1.422620000000      0.788334000000
  N                                                 1.765206000000     -0.157327000000      1.164490000000
  N                                                -1.771326000000     -0.081265000000     -1.164692000000
  N                                                 0.846355000000      1.588228000000     -1.125363000000
  C                                                 0.738354000000      2.867165000000     -0.338772000000
  H                                                 3.522736000000     -1.386984000000      1.135893000000
  H                                                 2.001302000000     -2.252121000000      1.300550000000
  H                                                 2.857264000000     -2.531090000000     -1.027803000000
  H                                                 2.968216000000     -0.788605000000     -1.220402000000
  H                                                -2.965540000000     -2.404079000000      1.028788000000
  H                                                -3.001107000000     -0.658112000000      1.219196000000
  H                                                -3.579527000000     -1.235079000000     -1.136554000000
  H                                                -2.096291000000     -2.164483000000     -1.299497000000
  H                                                -2.362756000000      0.735150000000     -1.010250000000
  H                                                -1.609574000000     -0.093550000000     -2.171636000000
  H                                                -0.655838000000     -2.389231000000      1.013613000000
  H                                                -1.001113000000     -1.293216000000      2.142374000000
  H                                                 0.550136000000     -2.416064000000     -1.010284000000
  H                                                 0.941873000000     -1.338186000000     -2.141433000000
  H                                                 2.390480000000      0.633399000000      1.009972000000
  H                                                 1.602819000000     -0.162719000000      2.171382000000
  C                                                -0.610551000000      2.897132000000      0.338045000000
  N                                                -0.774945000000      1.624430000000      1.124896000000
  H                                                 1.817285000000      1.452090000000     -1.405369000000
  H                                                 0.343548000000      1.706576000000     -2.005010000000
  H                                                 1.547070000000      2.884615000000      0.392932000000
  H                                                 0.872026000000      3.729136000000     -0.993286000000
  H                                                -0.705735000000      3.764310000000      0.992421000000
  H                                                -1.417928000000      2.950178000000     -0.393378000000
  H                                                -1.750811000000      1.531991000000      1.405639000000
  H                                                -0.266808000000      1.720469000000      2.004222000000
 Recover connectivity data from disk.
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 NAtoms=     37 NQM=       37 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          12          14         103          14          12          12          14          14          14
 AtmWgt=  12.0000000  12.0000000  14.0030740 102.9048000  14.0030740  12.0000000  12.0000000  14.0030740  14.0030740  14.0030740
 NucSpn=           0           0           2           1           2           0           0           2           2           2
 AtZEff=   3.6000000   3.6000000   4.5500000 229.5000000   4.5500000   3.6000000   3.6000000   4.5500000   4.5500000   4.5500000
 NQMom=    0.0000000   0.0000000   2.0440000   0.0000000   2.0440000   0.0000000   0.0000000   2.0440000   2.0440000   2.0440000
 NMagM=    0.0000000   0.0000000   0.4037610  -0.0884000   0.4037610   0.0000000   0.0000000   0.4037610   0.4037610   0.4037610
 AtZNuc=   6.0000000   6.0000000   7.0000000  45.0000000   7.0000000   6.0000000   6.0000000   7.0000000   7.0000000   7.0000000

  Atom        11          12          13          14          15          16          17          18          19          20
 IAtWgt=          12           1           1           1           1           1           1           1           1           1
 AtmWgt=  12.0000000   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           0           1           1           1           1           1           1           1           1           1
 AtZEff=   3.6000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   6.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000

  Atom        21          22          23          24          25          26          27          28          29          30
 IAtWgt=           1           1           1           1           1           1           1          12          14           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250  12.0000000  14.0030740   1.0078250
 NucSpn=           1           1           1           1           1           1           1           0           2           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   3.6000000   4.5500000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   2.0440000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   0.0000000   0.4037610   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   6.0000000   7.0000000   1.0000000

  Atom        31          32          33          34          35          36          37
 IAtWgt=           1           1           1           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 Using perturbation frequencies:    0.085645
 Leave Link  101 at Thu Jul  8 19:22:29 2021, MaxMem= 10737418240 cpu:               2.0 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -2.549130   -1.314427   -0.788263
      2          6           0       -2.489211   -1.476014    0.711136
      3          7           0       -1.044481   -1.454430    1.136257
      4         45           0       -0.000130    0.001194   -0.000069
      5          7           0        0.979011   -1.499359   -1.135079
      6          6           0        2.421772   -1.582914   -0.710906
      7          6           0        2.489662   -1.422620    0.788334
      8          7           0        1.765206   -0.157327    1.164490
      9          7           0       -1.771326   -0.081265   -1.164692
     10          7           0        0.846355    1.588228   -1.125363
     11          6           0        0.738354    2.867165   -0.338772
     12          1           0        3.522736   -1.386984    1.135893
     13          1           0        2.001302   -2.252121    1.300550
     14          1           0        2.857264   -2.531090   -1.027803
     15          1           0        2.968216   -0.788605   -1.220402
     16          1           0       -2.965540   -2.404079    1.028788
     17          1           0       -3.001107   -0.658112    1.219196
     18          1           0       -3.579527   -1.235079   -1.136554
     19          1           0       -2.096291   -2.164483   -1.299497
     20          1           0       -2.362756    0.735150   -1.010250
     21          1           0       -1.609574   -0.093550   -2.171636
     22          1           0       -0.655838   -2.389231    1.013613
     23          1           0       -1.001113   -1.293216    2.142374
     24          1           0        0.550136   -2.416064   -1.010284
     25          1           0        0.941873   -1.338186   -2.141433
     26          1           0        2.390480    0.633399    1.009972
     27          1           0        1.602819   -0.162719    2.171382
     28          6           0       -0.610551    2.897132    0.338045
     29          7           0       -0.774945    1.624430    1.124896
     30          1           0        1.817285    1.452090   -1.405369
     31          1           0        0.343548    1.706576   -2.005010
     32          1           0        1.547070    2.884615    0.392932
     33          1           0        0.872026    3.729136   -0.993286
     34          1           0       -0.705735    3.764310    0.992421
     35          1           0       -1.417928    2.950178   -0.393378
     36          1           0       -1.750811    1.531991    1.405639
     37          1           0       -0.266808    1.720469    2.004222
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  C    1.509271   0.000000
     3  N    2.446906   1.506134   0.000000
     4  Rh   2.974812   2.980517   2.121496   0.000000
     5  N    3.549966   3.929074   3.042286   2.120996   0.000000
     6  C    4.978748   5.113842   3.929813   2.979983   1.506142
     7  C    5.280794   4.979758   3.551370   2.974540   2.446931
     8  N    4.874999   4.477112   3.094772   2.120787   2.776179
     9  N    1.505778   2.445284   2.776374   2.121387   3.094547
    10  N    4.479772   4.887567   4.236503   2.121674   3.090451
    11  C    5.338099   5.512049   4.902081   2.978904   4.445059
    12  H    6.369866   6.027591   4.567715   3.953231   3.411815
    13  H    5.094001   4.595047   3.152792   3.282494   2.746638
    14  H    5.546778   5.720305   4.589768   3.953909   2.145649
    15  H    5.559167   5.829827   4.700947   3.305159   2.114093
    16  H    2.159262   1.090457   2.145659   3.954433   4.589153
    17  H    2.159844   1.090471   2.114092   3.305625   4.700175
    18  H    1.090560   2.158888   3.411780   3.953739   4.566193
    19  H    1.090421   2.161254   2.746521   3.282158   3.150699
    20  H    2.069971   2.805068   3.337604   2.672295   4.021942
    21  H    2.070514   3.315923   3.621254   2.704624   3.122743
    22  H    2.826042   2.070438   1.019773   2.677991   2.842795
    23  H    3.314429   2.072750   1.019874   2.695835   3.834721
    24  H    3.296718   3.617266   2.841686   2.677025   1.019733
    25  H    3.744160   4.464133   3.834367   2.695691   1.019855
    26  H    5.606017   5.324501   4.021683   2.671120   3.337985
    27  H    5.227295   4.538917   3.122210   2.703981   3.620556
    28  C    4.771152   4.774198   4.445394   2.978824   4.901626
    29  N    3.929986   3.566884   3.090657   2.121504   4.235789
    30  H    5.205768   5.621325   4.805978   2.717161   3.080067
    31  H    4.355975   5.052806   4.667563   2.654474   3.382102
    32  H    5.983814   5.950454   5.108422   3.295815   4.677257
    33  H    6.097858   6.426240   5.922610   3.955337   5.231511
    34  H    5.688806   5.542644   5.231700   3.955244   5.922064
    35  H    4.429719   4.686019   4.677587   3.295656   5.108211
    36  H    3.681388   3.174218   3.080613   2.717396   4.805857
    37  H    4.713551   4.102274   3.382029   2.654092   4.666323
                    6          7          8          9         10
     6  C    0.000000
     7  C    1.509312   0.000000
     8  N    2.445503   1.505754   0.000000
     9  N    4.476934   4.875404   4.235320   0.000000
    10  N    3.565088   3.927837   3.022363   3.104997   0.000000
    11  C    4.772377   4.768616   3.530124   3.959025   1.505347
    12  H    2.158976   1.090554   2.145177   5.918166   4.596540
    13  H    2.161154   1.090382   2.112443   5.002275   4.686922
    14  H    1.090465   2.159211   3.410790   5.238724   4.584981
    15  H    1.090465   2.160095   2.744714   4.792358   3.187579
    16  H    5.720488   5.548000   5.238919   3.410713   5.925321
    17  H    5.829937   5.560455   4.792861   2.743727   5.034478
    18  H    6.026421   6.369884   5.917983   2.145150   5.249726
    19  H    4.593208   5.093168   5.001107   2.112717   4.772036
    20  H    5.324916   5.606856   4.750377   1.019890   3.322557
    21  H    4.539129   5.227962   4.745834   1.019927   3.155099
    22  H    3.618811   3.298372   3.296303   3.363931   4.759410
    23  H    4.465565   3.746422   3.146271   3.605376   4.732226
    24  H    2.070456   2.825548   3.362727   3.296106   4.016882
    25  H    2.072776   3.314561   3.605750   3.145683   3.099261
    26  H    2.806144   2.070308   1.019849   4.749793   2.802798
    27  H    3.315904   2.070426   1.019917   4.745617   3.808751
    28  C    5.510544   5.336135   3.956887   3.532204   2.444866
    29  N    4.886330   4.478331   3.102997   3.023968   2.773732
    30  H    3.171582   3.678095   3.032674   3.909889   1.019628
    31  H    4.100544   4.711735   3.942204   2.893994   1.020098
    32  H    4.684269   4.426861   3.145838   4.715335   2.115855
    33  H    5.540697   5.686080   4.534133   4.640673   2.145132
    34  H    6.424596   6.095610   4.638361   4.536195   3.410180
    35  H    5.949205   5.982229   4.713373   3.147930   2.741840
    36  H    5.620751   5.205036   3.908238   3.034735   3.626900
    37  H    5.051012   4.353794   2.891427   3.943582   3.324293
                   11         12         13         14         15
    11  C    0.000000
    12  H    5.293884   0.000000
    13  H    5.521730   1.757935   0.000000
    14  H    5.840009   2.536417   2.496342   0.000000
    15  H    4.371980   2.493527   3.071156   1.756604   0.000000
    16  H    6.585975   6.568385   4.976592   6.176629   6.548135
    17  H    5.370141   6.564962   5.250865   6.548096   6.449921
    18  H    6.009073   7.458501   6.174099   6.566868   6.563483
    19  H    5.854544   6.173256   4.853678   4.974528   5.248669
    20  H    3.822729   6.614257   5.771359   6.157698   5.548446
    21  H    4.199761   6.241260   5.454716   5.215611   4.726956
    22  H    5.603786   4.298829   2.676103   4.065635   4.548252
    23  H    5.146902   4.635408   3.262309   5.144845   5.226707
    24  H    5.329058   3.808075   2.733627   2.310060   2.922308
    25  H    4.579955   4.171822   3.715496   2.516330   2.292685
    26  H    3.088421   2.319441   2.926110   3.792678   2.707479
    27  H    4.028445   2.501428   2.298421   4.173440   3.709480
    28  C    1.509478   6.006186   5.853460   6.584594   5.368518
    29  N    2.444747   5.247742   4.771378   5.924137   5.033330
    30  H    2.074647   4.174556   4.590974   4.133985   2.525781
    31  H    2.068620   5.435312   5.417209   5.023098   3.705458
    32  H    1.090741   4.764641   5.236044   5.750214   4.256178
    33  H    1.090528   6.142829   6.504797   6.567556   4.985537
    34  H    2.159245   6.666062   6.604577   7.510548   6.254881
    35  H    2.158570   6.749800   6.451701   6.980262   5.822433
    36  H    3.319880   6.033529   5.330000   6.607921   5.877965
    37  H    2.795511   4.977038   4.628277   6.085126   5.211433
                   16         17         18         19         20
    16  H    0.000000
    17  H    1.756679   0.000000
    18  H    2.536187   2.493395   0.000000
    19  H    2.496780   3.071101   1.757934   0.000000
    20  H    3.791541   2.705384   2.319113   2.926182   0.000000
    21  H    4.173716   3.708482   2.501039   2.299192   1.613333
    22  H    2.309800   2.922212   3.808312   2.734208   4.095284
    23  H    2.516558   2.292508   4.171686   3.715508   3.988405
    24  H    4.064226   4.546680   4.297067   2.674044   4.291281
    25  H    5.143375   5.225267   4.632869   3.259151   4.061880
    26  H    6.157400   5.548061   6.613605   5.770000   5.165743
    27  H    5.215278   4.727389   6.240922   5.453208   5.162822
    28  C    5.841741   4.373894   5.297587   5.523487   3.092295
    29  N    4.586592   3.189779   4.599633   4.688230   2.805497
    30  H    6.608372   5.878622   6.034792   5.329811   4.259444
    31  H    6.086993   5.212866   4.979766   4.629866   3.042581
    32  H    6.981278   5.824048   6.752274   6.452270   4.677164
    33  H    7.512125   6.256531   6.669354   6.606014   4.407727
    34  H    6.569404   4.987783   6.146959   6.506698   3.991519
    35  H    5.752019   4.257535   4.768773   5.238414   2.485876
    36  H    4.136451   2.528745   4.178950   4.593587   2.616477
    37  H    5.024592   3.708140   5.438184   5.417972   3.801433
                   21         22         23         24         25
    21  H    0.000000
    22  H    4.040492   0.000000
    23  H    4.518861   1.610765   0.000000
    24  H    3.377448   2.356110   3.688687   0.000000
    25  H    2.838999   3.689403   4.704064   1.610831   0.000000
    26  H    5.162511   4.291429   4.061660   4.094817   3.989607
    27  H    5.402412   3.376287   2.838895   4.038404   4.518733
    28  C    4.029978   5.329548   4.578991   5.603145   5.147402
    29  N    3.809880   4.016970   3.098237   4.758196   4.732173
    30  H    3.836604   5.169483   5.297788   4.089544   3.015589
    31  H    2.661372   5.185219   5.292226   4.245977   3.105991
    32  H    5.040920   5.749043   5.196928   5.573158   4.961987
    33  H    4.707417   6.617887   6.210075   6.153648   5.196236
    34  H    5.070628   6.153780   5.195018   6.617028   6.210565
    35  H    3.530327   5.574019   4.960863   5.748948   5.197540
    36  H    3.931822   4.090065   3.014402   5.168963   5.298130
    37  H    4.746733   4.245266   3.104929   5.183199   5.291761
                   26         27         28         29         30
    26  H    0.000000
    27  H    1.613408   0.000000
    28  C    3.818659   4.197954   0.000000
    29  N    3.318925   3.153220   1.505301   0.000000
    30  H    2.613939   3.930236   3.319944   3.626513   0.000000
    31  H    3.798915   4.745764   2.796003   3.324769   1.611283
    32  H    2.481945   3.528773   2.158355   2.741458   2.314958
    33  H    3.987773   5.069094   2.159330   3.410131   2.499653
    34  H    4.403346   4.705415   1.090535   2.145093   4.178683
    35  H    4.673417   5.039150   1.090711   2.115701   3.706076
    36  H    4.256091   3.834741   2.074502   1.019645   4.543067
    37  H    3.038327   2.658918   2.068536   1.020118   4.005094
                   31         32         33         34         35
    31  H    0.000000
    32  H    2.930250   0.000000
    33  H    2.322418   1.757982   0.000000
    34  H    3.784159   2.491662   2.536454   0.000000
    35  H    2.691970   3.068191   2.492098   1.757973   0.000000
    36  H    4.006164   3.705562   4.178703   2.499236   2.314849
    37  H    4.055449   2.691030   3.783747   2.322431   2.930145
                   36         37
    36  H    0.000000
    37  H    1.611239   0.000000
 Stoichiometry    C6H24N6Rh(3+)
 Framework group  C1[X(C6H24N6Rh)]
 Deg. of freedom   105
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 3.63D-14
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -2.549129   -1.314430   -0.788263
      2          6           0       -2.489209   -1.476017    0.711136
      3          7           0       -1.044479   -1.454431    1.136257
      4         45           0       -0.000130    0.001194   -0.000069
      5          7           0        0.979013   -1.499358   -1.135079
      6          6           0        2.421774   -1.582911   -0.710906
      7          6           0        2.489664   -1.422617    0.788334
      8          7           0        1.765206   -0.157325    1.164490
      9          7           0       -1.771326   -0.081267   -1.164692
     10          7           0        0.846353    1.588229   -1.125363
     11          6           0        0.738351    2.867166   -0.338772
     12          1           0        3.522738   -1.386980    1.135893
     13          1           0        2.001305   -2.252119    1.300550
     14          1           0        2.857267   -2.531087   -1.027803
     15          1           0        2.968217   -0.788602   -1.220402
     16          1           0       -2.965537   -2.404082    1.028788
     17          1           0       -3.001106   -0.658115    1.219196
     18          1           0       -3.579526   -1.235083   -1.136554
     19          1           0       -2.096289   -2.164485   -1.299497
     20          1           0       -2.362757    0.735147   -1.010250
     21          1           0       -1.609574   -0.093552   -2.171636
     22          1           0       -0.655835   -2.389232    1.013613
     23          1           0       -1.001112   -1.293217    2.142374
     24          1           0        0.550139   -2.416063   -1.010284
     25          1           0        0.941875   -1.338185   -2.141433
     26          1           0        2.390479    0.633402    1.009972
     27          1           0        1.602819   -0.162717    2.171382
     28          6           0       -0.610554    2.897131    0.338045
     29          7           0       -0.774947    1.624429    1.124896
     30          1           0        1.817283    1.452092   -1.405369
     31          1           0        0.343546    1.706576   -2.005010
     32          1           0        1.547067    2.884617    0.392932
     33          1           0        0.872022    3.729137   -0.993286
     34          1           0       -0.705739    3.764309    0.992421
     35          1           0       -1.417931    2.950176   -0.393378
     36          1           0       -1.750813    1.531989    1.405639
     37          1           0       -0.266810    1.720469    2.004222
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           0.7011504           0.6913191           0.4695393
 Leave Link  202 at Thu Jul  8 19:22:29 2021, MaxMem= 10737418240 cpu:               0.3 elap:               0.1
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:      12     13     14     15     16     17     18     19     20     21
 Centers:      22     23     24     25     26     27     30     31     32     33
 Centers:      34     35     36     37
 S 4 1.00
     Exponent=  1.3010000000D+01 Coefficients=  1.9685000000D-02
     Exponent=  1.9620000000D+00 Coefficients=  1.3797700000D-01
     Exponent=  4.4460000000D-01 Coefficients=  4.7814800000D-01
     Exponent=  1.2200000000D-01 Coefficients=  5.0124000000D-01
 S 1 1.00
     Exponent=  1.2200000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  2.9740000000D-02 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  7.2700000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.4100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      2      6      7     11     28
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients=  6.9200000000D-04
     Exponent=  1.0000000000D+03 Coefficients=  5.3290000000D-03
     Exponent=  2.2800000000D+02 Coefficients=  2.7077000000D-02
     Exponent=  6.4710000000D+01 Coefficients=  1.0171800000D-01
     Exponent=  2.1060000000D+01 Coefficients=  2.7474000000D-01
     Exponent=  7.4950000000D+00 Coefficients=  4.4856400000D-01
     Exponent=  2.7970000000D+00 Coefficients=  2.8507400000D-01
     Exponent=  5.2150000000D-01 Coefficients=  1.5204000000D-02
     Exponent=  1.5960000000D-01 Coefficients= -3.1910000000D-03
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients= -1.4600000000D-04
     Exponent=  1.0000000000D+03 Coefficients= -1.1540000000D-03
     Exponent=  2.2800000000D+02 Coefficients= -5.7250000000D-03
     Exponent=  6.4710000000D+01 Coefficients= -2.3312000000D-02
     Exponent=  2.1060000000D+01 Coefficients= -6.3955000000D-02
     Exponent=  7.4950000000D+00 Coefficients= -1.4998100000D-01
     Exponent=  2.7970000000D+00 Coefficients= -1.2726200000D-01
     Exponent=  5.2150000000D-01 Coefficients=  5.4452900000D-01
     Exponent=  1.5960000000D-01 Coefficients=  5.8049600000D-01
 S 1 1.00
     Exponent=  1.5960000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  4.6900000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  9.4390000000D+00 Coefficients=  3.8109000000D-02
     Exponent=  2.0020000000D+00 Coefficients=  2.0948000000D-01
     Exponent=  5.4560000000D-01 Coefficients=  5.0855700000D-01
     Exponent=  1.5170000000D-01 Coefficients=  4.6884200000D-01
 P 1 1.00
     Exponent=  1.5170000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  4.0410000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  5.5000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.5100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       3      5      8      9     10     29
 S 9 1.00
     Exponent=  9.0460000000D+03 Coefficients=  7.0000000000D-04
     Exponent=  1.3570000000D+03 Coefficients=  5.3890000000D-03
     Exponent=  3.0930000000D+02 Coefficients=  2.7406000000D-02
     Exponent=  8.7730000000D+01 Coefficients=  1.0320700000D-01
     Exponent=  2.8560000000D+01 Coefficients=  2.7872300000D-01
     Exponent=  1.0210000000D+01 Coefficients=  4.4854000000D-01
     Exponent=  3.8380000000D+00 Coefficients=  2.7823800000D-01
     Exponent=  7.4660000000D-01 Coefficients=  1.5440000000D-02
     Exponent=  2.2480000000D-01 Coefficients= -2.8640000000D-03
 S 9 1.00
     Exponent=  9.0460000000D+03 Coefficients= -1.5300000000D-04
     Exponent=  1.3570000000D+03 Coefficients= -1.2080000000D-03
     Exponent=  3.0930000000D+02 Coefficients= -5.9920000000D-03
     Exponent=  8.7730000000D+01 Coefficients= -2.4544000000D-02
     Exponent=  2.8560000000D+01 Coefficients= -6.7459000000D-02
     Exponent=  1.0210000000D+01 Coefficients= -1.5807800000D-01
     Exponent=  3.8380000000D+00 Coefficients= -1.2183100000D-01
     Exponent=  7.4660000000D-01 Coefficients=  5.4900300000D-01
     Exponent=  2.2480000000D-01 Coefficients=  5.7881500000D-01
 S 1 1.00
     Exponent=  2.2480000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  6.1240000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  1.3550000000D+01 Coefficients=  3.9919000000D-02
     Exponent=  2.9170000000D+00 Coefficients=  2.1716900000D-01
     Exponent=  7.9730000000D-01 Coefficients=  5.1031900000D-01
     Exponent=  2.1850000000D-01 Coefficients=  4.6221400000D-01
 P 1 1.00
     Exponent=  2.1850000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  5.6110000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  8.1700000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  2.3000000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       4
 S 7 1.00
     Exponent=  1.8466600000D+02 Coefficients=  6.9200000000D-04
     Exponent=  2.1997400000D+01 Coefficients= -3.8393000000D-02
     Exponent=  1.3761600000D+01 Coefficients=  1.7601900000D-01
     Exponent=  5.0872000000D+00 Coefficients= -6.2992500000D-01
     Exponent=  1.2294000000D+00 Coefficients=  8.4954400000D-01
     Exponent=  5.5681400000D-01 Coefficients=  4.4572900000D-01
     Exponent=  1.1406700000D-01 Coefficients=  1.8204000000D-02
 S 7 1.00
     Exponent=  1.8466600000D+02 Coefficients= -1.7800000000D-04
     Exponent=  2.1997400000D+01 Coefficients=  9.4560000000D-03
     Exponent=  1.3761600000D+01 Coefficients= -4.9472000000D-02
     Exponent=  5.0872000000D+00 Coefficients=  2.0186700000D-01
     Exponent=  1.2294000000D+00 Coefficients= -3.6980900000D-01
     Exponent=  5.5681400000D-01 Coefficients= -2.6533100000D-01
     Exponent=  1.1406700000D-01 Coefficients=  5.8915400000D-01
 S 7 1.00
     Exponent=  1.8466600000D+02 Coefficients=  8.3700000000D-04
     Exponent=  2.1997400000D+01 Coefficients= -4.0286000000D-02
     Exponent=  1.3761600000D+01 Coefficients=  1.5064900000D-01
     Exponent=  5.0872000000D+00 Coefficients= -5.2685100000D-01
     Exponent=  1.2294000000D+00 Coefficients=  1.5723820000D+00
     Exponent=  5.5681400000D-01 Coefficients= -8.8764300000D-01
     Exponent=  1.1406700000D-01 Coefficients= -1.4709450000D+00
 S 1 1.00
     Exponent=  4.1415000000D-02 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  1.5000000000D-02 Coefficients=  1.0000000000D+00
 P 6 1.00
     Exponent=  1.3698500000D+01 Coefficients=  3.1821000000D-02
     Exponent=  6.6247600000D+00 Coefficients= -1.9302800000D-01
     Exponent=  1.6961300000D+00 Coefficients=  5.0624200000D-01
     Exponent=  7.9735100000D-01 Coefficients=  4.9490200000D-01
     Exponent=  3.5203400000D-01 Coefficients=  1.4403000000D-01
     Exponent=  1.2334200000D-01 Coefficients=  5.6080000000D-03
 P 6 1.00
     Exponent=  1.3698500000D+01 Coefficients= -8.5830000000D-03
     Exponent=  6.6247600000D+00 Coefficients=  5.6811000000D-02
     Exponent=  1.6961300000D+00 Coefficients= -1.8017200000D-01
     Exponent=  7.9735100000D-01 Coefficients= -2.0341100000D-01
     Exponent=  3.5203400000D-01 Coefficients=  8.4818000000D-02
     Exponent=  1.2334200000D-01 Coefficients=  6.0105700000D-01
 P 6 1.00
     Exponent=  1.3698500000D+01 Coefficients= -1.5164000000D-02
     Exponent=  6.6247600000D+00 Coefficients=  1.0112500000D-01
     Exponent=  1.6961300000D+00 Coefficients= -3.4564100000D-01
     Exponent=  7.9735100000D-01 Coefficients= -3.4548500000D-01
     Exponent=  3.5203400000D-01 Coefficients=  4.2210200000D-01
     Exponent=  1.2334200000D-01 Coefficients=  7.3047900000D-01
 P 1 1.00
     Exponent=  4.3130000000D-02 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.5100000000D-02 Coefficients=  1.0000000000D+00
 D 5 1.00
     Exponent=  1.8737000000D+01 Coefficients=  6.4810000000D-03
     Exponent=  1.1704600000D+01 Coefficients= -1.3942000000D-02
     Exponent=  2.2555800000D+00 Coefficients=  2.5068200000D-01
     Exponent=  9.4941100000D-01 Coefficients=  4.5111100000D-01
     Exponent=  3.6616400000D-01 Coefficients=  3.8399900000D-01
 D 5 1.00
     Exponent=  1.8737000000D+01 Coefficients= -7.5900000000D-03
     Exponent=  1.1704600000D+01 Coefficients=  1.6294000000D-02
     Exponent=  2.2555800000D+00 Coefficients= -3.3477300000D-01
     Exponent=  9.4941100000D-01 Coefficients= -4.4639600000D-01
     Exponent=  3.6616400000D-01 Coefficients=  3.2996700000D-01
 D 1 1.00
     Exponent=  1.2397700000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  4.2000000000D-02 Coefficients=  1.0000000000D+00
 F 1 1.00
     Exponent=  9.9360000000D-01 Coefficients=  1.0000000000D+00
 F 1 1.00
     Exponent=  3.2220000000D-01 Coefficients=  1.0000000000D+00
 ****
 ======================================================================================================
                                       Pseudopotential Parameters
 ======================================================================================================
  Center     Atomic      Valence      Angular      Power
  Number     Number     Electrons     Momentum     of R      Exponent        Coefficient   SO-Coeffient
 ======================================================================================================
    1          6
                                   No pseudopotential on this center.
    2          6
                                   No pseudopotential on this center.
    3          7
                                   No pseudopotential on this center.
    4         45           17
                                      G and up 
                                                     2        1.0000000        0.00000000    0.00000000
                                      S - G
                                                     2       12.1948160      225.31205400    0.00000000
                                                     2        5.4051370       32.44158200    0.00000000
                                      P - G
                                                     2       11.2807550       52.87282600    0.00000000
                                                     2       10.9272480      105.74552600    0.00000000
                                                     2        5.0901170        8.61934400    0.00000000
                                                     2        4.8518320       16.97345900    0.00000000
                                      D - G
                                                     2        9.1363370       25.10850100    0.00000000
                                                     2        8.9648080       37.69573100    0.00000000
                                                     2        3.6436120        4.20258400    0.00000000
                                                     2        3.6360070        6.29279000    0.00000000
                                      F - G
                                                     2        8.6162280       -9.67356800    0.00000000
                                                     2        8.6294350      -12.89984700    0.00000000
    5          7
                                   No pseudopotential on this center.
    6          6
                                   No pseudopotential on this center.
    7          6
                                   No pseudopotential on this center.
    8          7
                                   No pseudopotential on this center.
    9          7
                                   No pseudopotential on this center.
   10          7
                                   No pseudopotential on this center.
   11          6
                                   No pseudopotential on this center.
   12          1
                                   No pseudopotential on this center.
   13          1
                                   No pseudopotential on this center.
   14          1
                                   No pseudopotential on this center.
   15          1
                                   No pseudopotential on this center.
   16          1
                                   No pseudopotential on this center.
   17          1
                                   No pseudopotential on this center.
   18          1
                                   No pseudopotential on this center.
   19          1
                                   No pseudopotential on this center.
   20          1
                                   No pseudopotential on this center.
   21          1
                                   No pseudopotential on this center.
   22          1
                                   No pseudopotential on this center.
   23          1
                                   No pseudopotential on this center.
   24          1
                                   No pseudopotential on this center.
   25          1
                                   No pseudopotential on this center.
   26          1
                                   No pseudopotential on this center.
   27          1
                                   No pseudopotential on this center.
   28          6
                                   No pseudopotential on this center.
   29          7
                                   No pseudopotential on this center.
   30          1
                                   No pseudopotential on this center.
   31          1
                                   No pseudopotential on this center.
   32          1
                                   No pseudopotential on this center.
   33          1
                                   No pseudopotential on this center.
   34          1
                                   No pseudopotential on this center.
   35          1
                                   No pseudopotential on this center.
   36          1
                                   No pseudopotential on this center.
   37          1
                                   No pseudopotential on this center.
 ======================================================================================================
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 Ernie:  50 primitive shells out of 585 were deleted.
 There are   580 symmetry adapted cartesian basis functions of A   symmetry.
 There are   546 symmetry adapted basis functions of A   symmetry.
   546 basis functions,   991 primitive gaussians,   580 cartesian basis functions
    58 alpha electrons       58 beta electrons
       nuclear repulsion energy      1198.2090739051 Hartrees.
 IExCor=  402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX=  0.200000
 ScaDFX=  0.800000  0.720000  1.000000  0.810000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=141
 NAtoms=   37 NActive=   37 NUniq=   37 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 R6Disp:  Grimme-D3(BJ) Dispersion energy=       -0.0806419341 Hartrees.
 Nuclear repulsion after empirical dispersion term =     1198.1284319711 Hartrees.
 Leave Link  301 at Thu Jul  8 19:22:32 2021, MaxMem= 10737418240 cpu:              41.1 elap:               2.7
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
   1 Symmetry operations used in ECPInt.
 ECPInt:  NShTT=   29890 NPrTT=  144244 LenC2=   29884 LenP2D=  115137.
 LDataN:  DoStor=T MaxTD1= 7 Len=  274
 NBasis=   546 RedAO= T EigKep=  1.16D-06  NBF=   546
 NBsUse=   546 1.00D-06 EigRej= -1.00D+00 NBFU=   546
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Defaulting to unpruned grid for atomic number  45.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   580   580   580   580   580 MxSgAt=    37 MxSgA2=    37.
 Leave Link  302 at Thu Jul  8 19:22:34 2021, MaxMem= 10737418240 cpu:              30.3 elap:               2.0
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Thu Jul  8 19:22:35 2021, MaxMem= 10737418240 cpu:               3.4 elap:               0.3
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "36b_RhEn3-lel2ob_STD_B3LYPDBJ-augccpVDZr.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=     0.000000   -0.000000   -0.000000
         Rot=    1.000000    0.000000   -0.000000   -0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Thu Jul  8 19:22:37 2021, MaxMem= 10737418240 cpu:              23.7 elap:               1.5
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot= 10737418240 LenX= 10736730423 LenY= 10736393443
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf= 990000000 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=         0 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 E= -681.123123267850    
 DIIS: error= 3.91D-02 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -681.123123267850     IErMin= 1 ErrMin= 3.91D-02
 ErrMax= 3.91D-02  0.00D+00 EMaxC= 1.00D-01 BMatC= 9.66D-02 BMatP= 9.66D-02
 IDIUse=3 WtCom= 6.09D-01 WtEn= 3.91D-01
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.230 Goal=   None    Shift=    0.000
 GapD=    0.230 DampG=1.000 DampE=0.250 DampFc=0.2500 IDamp=-1.
 Damping current iteration by 2.50D-01
 RMSDP=3.39D-02 MaxDP=1.23D+01              OVMax= 1.18D-02

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  6.45D-03    CP:  1.23D+00
 E= -681.126254310139     Delta-E=       -0.003131042289 Rises=F Damp=T
 DIIS: error= 2.94D-02 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -681.126254310139     IErMin= 2 ErrMin= 2.94D-02
 ErrMax= 2.94D-02  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.43D-02 BMatP= 9.66D-02
 IDIUse=3 WtCom= 7.06D-01 WtEn= 2.94D-01
 Coeff-Com: -0.293D+01 0.393D+01
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:     -0.207D+01 0.307D+01
 Gap=     0.235 Goal=   None    Shift=    0.000
 RMSDP=2.88D-02 MaxDP=1.07D+01 DE=-3.13D-03 OVMax= 1.94D-02

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  9.08D-03    CP:  1.99D+00  3.00D+00
 E= -681.132357970726     Delta-E=       -0.006103660587 Rises=F Damp=F
 DIIS: error= 4.02D-03 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 3 EnMin= -681.132357970726     IErMin= 3 ErrMin= 4.02D-03
 ErrMax= 4.02D-03  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.70D-03 BMatP= 5.43D-02
 IDIUse=3 WtCom= 9.60D-01 WtEn= 4.02D-02
 Coeff-Com: -0.192D+01 0.256D+01 0.363D+00
 Coeff-En:   0.000D+00 0.000D+00 0.100D+01
 Coeff:     -0.184D+01 0.245D+01 0.389D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=1.98D-03 MaxDP=7.84D-01 DE=-6.10D-03 OVMax= 1.65D-02

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  7.52D-04    CP:  1.95D+00  3.00D+00  8.42D-01
 E= -681.135613730678     Delta-E=       -0.003255759952 Rises=F Damp=F
 DIIS: error= 6.86D-04 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -681.135613730678     IErMin= 4 ErrMin= 6.86D-04
 ErrMax= 6.86D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.60D-04 BMatP= 4.70D-03
 IDIUse=3 WtCom= 9.93D-01 WtEn= 6.86D-03
 Coeff-Com: -0.664D+00 0.883D+00 0.224D+00 0.556D+00
 Coeff-En:   0.000D+00 0.000D+00 0.369D-01 0.963D+00
 Coeff:     -0.659D+00 0.877D+00 0.223D+00 0.559D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=4.34D-04 MaxDP=1.71D-01 DE=-3.26D-03 OVMax= 2.60D-03

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  2.66D-05    CP:  1.96D+00  3.00D+00  8.77D-01  8.17D-01
 E= -681.135739574401     Delta-E=       -0.000125843723 Rises=F Damp=F
 DIIS: error= 3.12D-05 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -681.135739574401     IErMin= 5 ErrMin= 3.12D-05
 ErrMax= 3.12D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.11D-06 BMatP= 1.60D-04
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.136D+00 0.180D+00 0.735D-01 0.246D+00 0.636D+00
 Coeff:     -0.136D+00 0.180D+00 0.735D-01 0.246D+00 0.636D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=4.03D-05 MaxDP=1.57D-02 DE=-1.26D-04 OVMax= 1.39D-04

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  7.08D-06    CP:  1.96D+00  3.00D+00  8.80D-01  8.02D-01  8.77D-01
 E= -681.135740549765     Delta-E=       -0.000000975363 Rises=F Damp=F
 DIIS: error= 5.43D-06 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -681.135740549765     IErMin= 6 ErrMin= 5.43D-06
 ErrMax= 5.43D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.98D-08 BMatP= 1.11D-06
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.358D-02-0.485D-02 0.106D-01 0.552D-01 0.256D+00 0.679D+00
 Coeff:      0.358D-02-0.485D-02 0.106D-01 0.552D-01 0.256D+00 0.679D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=7.37D-06 MaxDP=2.79D-03 DE=-9.75D-07 OVMax= 2.84D-05

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  1.80D-06    CP:  1.96D+00  3.00D+00  8.81D-01  8.00D-01  8.77D-01
                    CP:  9.60D-01
 E= -681.135740596432     Delta-E=       -0.000000046667 Rises=F Damp=F
 DIIS: error= 2.18D-06 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -681.135740596432     IErMin= 7 ErrMin= 2.18D-06
 ErrMax= 2.18D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.62D-09 BMatP= 5.98D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.648D-02-0.867D-02 0.115D-02 0.126D-01 0.794D-01 0.310D+00
 Coeff-Com:  0.599D+00
 Coeff:      0.648D-02-0.867D-02 0.115D-02 0.126D-01 0.794D-01 0.310D+00
 Coeff:      0.599D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=2.63D-06 MaxDP=1.04D-03 DE=-4.67D-08 OVMax= 1.44D-05

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  3.89D-07    CP:  1.96D+00  3.00D+00  8.80D-01  8.02D-01  8.81D-01
                    CP:  9.61D-01  8.62D-01
 E= -681.135740600734     Delta-E=       -0.000000004302 Rises=F Damp=F
 DIIS: error= 5.75D-07 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -681.135740600734     IErMin= 8 ErrMin= 5.75D-07
 ErrMax= 5.75D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 6.26D-10 BMatP= 5.62D-09
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.266D-02-0.355D-02-0.617D-03-0.215D-04 0.102D-01 0.787D-01
 Coeff-Com:  0.317D+00 0.596D+00
 Coeff:      0.266D-02-0.355D-02-0.617D-03-0.215D-04 0.102D-01 0.787D-01
 Coeff:      0.317D+00 0.596D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=1.76D-07 MaxDP=5.18D-05 DE=-4.30D-09 OVMax= 3.10D-06

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  9.38D-08    CP:  1.96D+00  3.00D+00  8.80D-01  8.01D-01  8.80D-01
                    CP:  9.64D-01  8.66D-01  7.86D-01
 E= -681.135740601464     Delta-E=       -0.000000000731 Rises=F Damp=F
 DIIS: error= 1.33D-07 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -681.135740601464     IErMin= 9 ErrMin= 1.33D-07
 ErrMax= 1.33D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 8.58D-12 BMatP= 6.26D-10
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.173D-03-0.230D-03-0.125D-03-0.558D-03-0.978D-03 0.291D-02
 Coeff-Com:  0.365D-01 0.985D-01 0.864D+00
 Coeff:      0.173D-03-0.230D-03-0.125D-03-0.558D-03-0.978D-03 0.291D-02
 Coeff:      0.365D-01 0.985D-01 0.864D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=2.39D-07 MaxDP=9.37D-05 DE=-7.31D-10 OVMax= 5.55D-07

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  1.47D-08    CP:  1.96D+00  3.00D+00  8.80D-01  8.01D-01  8.80D-01
                    CP:  9.65D-01  8.71D-01  7.86D-01  9.19D-01
 E= -681.135740601269     Delta-E=        0.000000000196 Rises=F Damp=F
 DIIS: error= 3.15D-08 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin= 9 EnMin= -681.135740601464     IErMin=10 ErrMin= 3.15D-08
 ErrMax= 3.15D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.59D-13 BMatP= 8.58D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.330D-06-0.125D-07-0.351D-04-0.251D-03-0.752D-03-0.105D-02
 Coeff-Com:  0.575D-02 0.222D-01 0.313D+00 0.661D+00
 Coeff:      0.330D-06-0.125D-07-0.351D-04-0.251D-03-0.752D-03-0.105D-02
 Coeff:      0.575D-02 0.222D-01 0.313D+00 0.661D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=2.80D-08 MaxDP=1.09D-05 DE= 1.96D-10 OVMax= 1.72D-07

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  4.02D-09    CP:  1.96D+00  3.00D+00  8.80D-01  8.01D-01  8.80D-01
                    CP:  9.65D-01  8.71D-01  7.86D-01  9.25D-01  9.72D-01
 E= -681.135740601456     Delta-E=       -0.000000000187 Rises=F Damp=F
 DIIS: error= 1.08D-08 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin= 9 EnMin= -681.135740601464     IErMin=11 ErrMin= 1.08D-08
 ErrMax= 1.08D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.63D-13 BMatP= 5.59D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.256D-04 0.343D-04-0.621D-05-0.987D-04-0.402D-03-0.119D-02
 Coeff-Com: -0.150D-02 0.846D-03 0.872D-01 0.450D+00 0.465D+00
 Coeff:     -0.256D-04 0.343D-04-0.621D-05-0.987D-04-0.402D-03-0.119D-02
 Coeff:     -0.150D-02 0.846D-03 0.872D-01 0.450D+00 0.465D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=8.47D-09 MaxDP=3.27D-06 DE=-1.87D-10 OVMax= 8.72D-08

 Cycle  12  Pass 1  IDiag  1:
 RMSU=  1.56D-09    CP:  1.96D+00  3.00D+00  8.80D-01  8.01D-01  8.80D-01
                    CP:  9.65D-01  8.72D-01  7.86D-01  9.26D-01  9.91D-01
                    CP:  8.72D-01
 E= -681.135740601477     Delta-E=       -0.000000000022 Rises=F Damp=F
 DIIS: error= 1.49D-09 at cycle  12 NSaved=  12.
 NSaved=12 IEnMin=12 EnMin= -681.135740601477     IErMin=12 ErrMin= 1.49D-09
 ErrMax= 1.49D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.31D-15 BMatP= 1.63D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.667D-05 0.889D-05 0.110D-05-0.762D-05-0.519D-04-0.197D-03
 Coeff-Com: -0.813D-03-0.129D-02-0.247D-02 0.632D-01 0.123D+00 0.819D+00
 Coeff:     -0.667D-05 0.889D-05 0.110D-05-0.762D-05-0.519D-04-0.197D-03
 Coeff:     -0.813D-03-0.129D-02-0.247D-02 0.632D-01 0.123D+00 0.819D+00
 Gap=     0.231 Goal=   None    Shift=    0.000
 RMSDP=2.00D-09 MaxDP=7.76D-07 DE=-2.18D-11 OVMax= 1.31D-08

 SCF Done:  E(RB3LYP) =  -681.135740601     A.U. after   12 cycles
            NFock= 12  Conv=0.20D-08     -V/T= 2.1210
 KE= 6.075977422160D+02 PE=-3.904519790992D+03 EE= 1.417657876204D+03
 Leave Link  502 at Thu Jul  8 19:32:57 2021, MaxMem= 10737418240 cpu:            9899.3 elap:             619.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   546
 NBasis=   546 NAE=    58 NBE=    58 NFC=     0 NFV=     0
 NROrb=    546 NOA=    58 NOB=    58 NVA=   488 NVB=   488

 **** Warning!!: The largest alpha MO coefficient is  0.33725681D+03

 Leave Link  801 at Thu Jul  8 19:32:58 2021, MaxMem= 10737418240 cpu:               2.0 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
 Defaulting to unpruned grid for atomic number  45.
        11517 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=   10737418240 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.085645
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          37
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
   1 Symmetry operations used in ECPInt.
 ECPInt:  NShTT=   29890 NPrTT=  144244 LenC2=   29891 LenP2D=  144244.
 LDataN:  DoStor=T MaxTD1= 8 Len=  415
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=F KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 Defaulting to unpruned grid for atomic number  45.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 4.72D-13 8.33D-09 XBig12= 1.00D+00 3.41D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 4.72D-13 8.33D-09 XBig12= 2.63D-01 7.72D-02.
     11 vectors produced by pass  2 Test12= 4.72D-13 8.33D-09 XBig12= 9.68D-02 6.20D-02.
     11 vectors produced by pass  3 Test12= 4.72D-13 8.33D-09 XBig12= 2.07D-02 1.61D-02.
     11 vectors produced by pass  4 Test12= 4.72D-13 8.33D-09 XBig12= 2.98D-03 9.65D-03.
     11 vectors produced by pass  5 Test12= 4.72D-13 8.33D-09 XBig12= 7.70D-04 6.87D-03.
     11 vectors produced by pass  6 Test12= 4.72D-13 8.33D-09 XBig12= 9.19D-05 2.19D-03.
     11 vectors produced by pass  7 Test12= 4.72D-13 8.33D-09 XBig12= 2.76D-06 1.80D-04.
     11 vectors produced by pass  8 Test12= 4.72D-13 8.33D-09 XBig12= 1.04D-07 4.27D-05.
     11 vectors produced by pass  9 Test12= 4.72D-13 8.33D-09 XBig12= 2.50D-09 1.02D-05.
     10 vectors produced by pass 10 Test12= 4.72D-13 8.33D-09 XBig12= 4.82D-11 1.72D-06.
      6 vectors produced by pass 11 Test12= 4.72D-13 8.33D-09 XBig12= 1.42D-12 2.51D-07.
      1 vectors produced by pass 12 Test12= 4.72D-13 8.33D-09 XBig12= 6.43D-14 2.55D-08.
 InvSVY:  IOpt=1 It=  1 EMax= 4.26D-14
 Solved reduced A of dimension   127 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.085645:
                1             2             3 
      1  0.157335D+03
      2 -0.354289D-02  0.156142D+03
      3 -0.259076D-01 -0.674557D-03  0.126187D+03
 Isotropic polarizability for W=    0.085645      146.55 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.085645:
                 1             2             3 
      1  -0.667462D+01 -0.103257D+03 -0.231700D+00
      2   0.681087D+01  0.109894D+03  0.212657D+00
      3  -0.136247D+00 -0.663702D+01  0.190430D-01
      4  -0.100433D+03  0.685855D+01 -0.520817D+01
      5  -0.201947D+00  0.139852D+01 -0.239869D+00
      6  -0.102715D+02  0.181791D+00 -0.100262D+02
 Dipole-magnetic dipole polarizability for W=    0.085645:
                 1             2             3 
      1  -0.307068D+01  0.122552D+00  0.210596D+01
      2   0.718410D-01  0.181442D+01 -0.394964D-01
      3   0.270821D+01 -0.102076D+00 -0.284749D+01
 DQ contribution to OR G for W=    0.085645:
                 1             2             3 
      1   0.660669D+01 -0.308659D-01  0.338921D+01
      2  -0.297523D-01  0.506334D+01 -0.103622D+00
      3   0.282367D+01 -0.476813D-01 -0.116700D+02
 Optical Rotation G' tensor for W=    0.085645:
                 1             2             3 
      1   0.113514D+01 -0.561755D-01 -0.426933D+00
      2  -0.561755D-01 -0.169325D+01  0.164803D-01
      3  -0.426933D+00  0.164803D-01 -0.354564D+01
 OR G Eigenvalues:    -3.5843    -1.6943     1.1749  Iso=     1.3679
 Eigenvectors:
   (1)   0.090022  -0.006005   0.995922
   (2)   0.020480   0.999782   0.004177
   (3)   0.995729  -0.020020  -0.090125
 w=    0.085645 a.u., Optical Rotation Beta=      1.3679 au.
 Molar Mass =    283.2013 grams/mole, [Alpha] ( 5320.0 A) =      229.08 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=  149331 ScalPx= 1.09D+02
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=  149331 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 8.12D+02
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 7.86D-14 2.78D-09 XBig12= 1.00D+00 3.68D-01.
     30 vectors produced by pass  1 Test12= 7.86D-14 2.78D-09 XBig12= 1.00D+00 3.85D-01.
     30 vectors produced by pass  2 Test12= 7.86D-14 2.78D-09 XBig12= 1.07D-02 1.77D-02.
     30 vectors produced by pass  3 Test12= 7.86D-14 2.78D-09 XBig12= 6.74D-04 3.20D-03.
     30 vectors produced by pass  4 Test12= 7.86D-14 2.78D-09 XBig12= 1.54D-05 3.96D-04.
     30 vectors produced by pass  5 Test12= 7.86D-14 2.78D-09 XBig12= 1.36D-07 5.64D-05.
     30 vectors produced by pass  6 Test12= 7.86D-14 2.78D-09 XBig12= 7.55D-10 2.52D-06.
     30 vectors produced by pass  7 Test12= 7.86D-14 2.78D-09 XBig12= 3.88D-12 2.07D-07.
      8 vectors produced by pass  8 Test12= 7.86D-14 2.78D-09 XBig12= 2.27D-14 1.50D-08.
      3 vectors produced by pass  9 Test12= 7.86D-14 2.78D-09 XBig12= 3.11D-15 6.82D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 2.89D-15
 Solved reduced A of dimension   251 with    30 vectors.
 ECPInt:  NShTT=   29890 NPrTT=  144244 LenC2=   29891 LenP2D=  144244.
 LDataN:  DoStor=T MaxTD1= 8 Len=  415
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=  149331 ScalPx= 4.44D+03
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=  149331 ScalPx= 4.44D+03
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=  149331 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 3.72D+03
 FullF1:  Do perturbations      1 to      30.
 ECPInt:  NShTT=   29890 NPrTT=  144244 LenC2=   29891 LenP2D=  144244.
 LDataN:  DoStor=T MaxTD1= 9 Len=  602
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.157335D+03 -0.354289D-02 -0.259076D-01
      2  -0.354289D-02  0.156142D+03 -0.674557D-03
      3  -0.259076D-01 -0.674557D-03  0.126187D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1  -0.307068D+01  0.122552D+00  0.210596D+01
      2   0.718410D-01  0.181442D+01 -0.394964D-01
      3   0.270821D+01 -0.102076D+00 -0.284749D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.667462D+01 -0.103257D+03 -0.231700D+00
      2   0.681087D+01  0.109894D+03  0.212657D+00
      3  -0.136247D+00 -0.663702D+01  0.190430D-01
      4  -0.100433D+03  0.685855D+01 -0.520817D+01
      5  -0.201947D+00  0.139852D+01 -0.239869D+00
      6  -0.102715D+02  0.181791D+00 -0.100262D+02
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=   111 ND12= 1 LenFil=    3999:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.888347D+01  0.104540D+01  0.438423D+01 -0.884531D+00 -0.295936D+01
      2   0.104540D+01 -0.263258D+01  0.945601D-01 -0.295936D+01  0.702678D+00
      3   0.438423D+01  0.945601D-01  0.577985D+00 -0.648211D+00  0.230730D+01
                 6             7             8             9            10 
      1  -0.648211D+00  0.317129D+01 -0.370549D+00  0.689623D+00 -0.104849D+01
      2   0.230730D+01 -0.370549D+00  0.160519D+01  0.127923D+01  0.111142D+01
      3   0.104187D+01  0.689623D+00  0.127923D+01 -0.526016D+00 -0.265325D+01
                11            12            13            14            15 
      1   0.111142D+01 -0.265325D+01  0.255445D+01  0.591839D+01 -0.106102D+01
      2   0.445208D+01 -0.260773D+00  0.591839D+01  0.304236D+01 -0.379239D+01
      3  -0.260773D+00  0.930320D+00 -0.106102D+01 -0.379239D+01 -0.237408D+00
                16            17            18            19            20 
      1  -0.171911D+01 -0.394661D+00  0.126514D+01 -0.278029D+01 -0.416452D+01
      2  -0.394661D+00 -0.284902D+01 -0.223270D+00 -0.416452D+01 -0.658638D+01
      3   0.126514D+01 -0.223270D+00  0.607340D+00  0.346071D+01  0.261656D+01
                21            22            23            24            25 
      1   0.346071D+01 -0.195974D+01 -0.439296D+01  0.138689D+01  0.196453D+01
      2   0.261656D+01 -0.439296D+01 -0.272914D+01  0.278444D+01  0.131073D+01
      3  -0.139492D+01  0.138689D+01  0.278444D+01 -0.159788D+01 -0.117612D+01
                26            27            28            29            30 
      1   0.131073D+01 -0.117612D+01  0.116195D+00  0.205626D+01  0.183767D-02
      2   0.305679D+01 -0.185894D+01  0.205626D+01 -0.160259D+00 -0.168694D+01
      3  -0.185894D+01 -0.189127D+01  0.183767D-02 -0.168694D+01  0.307991D-02
                31            32            33            34            35 
      1   0.192979D+01 -0.143395D+00  0.197756D+01 -0.550436D-02 -0.651887D-01
      2  -0.143395D+00 -0.241353D+01 -0.207061D-02 -0.651887D-01  0.237576D-02
      3   0.197756D+01 -0.207061D-02  0.270907D+00  0.323634D-02  0.132091D+00
                36            37            38            39            40 
      1   0.323634D-02  0.235243D+01 -0.378349D+01 -0.327844D+01 -0.167542D+01
      2   0.132091D+00 -0.378349D+01  0.680207D+01  0.263349D+01  0.450955D+01
      3  -0.287421D-02 -0.327844D+01  0.263349D+01  0.132526D+01  0.140141D+01
                41            42            43            44            45 
      1   0.450955D+01  0.140141D+01 -0.185841D+01  0.125333D+01  0.109133D+01
      2  -0.341591D+01 -0.296406D+01  0.125333D+01 -0.317584D+01 -0.189691D+01
      3  -0.296406D+01 -0.164743D+01  0.109133D+01 -0.189691D+01  0.189449D+01
                46            47            48            49            50 
      1   0.123713D+01  0.614392D+00  0.259529D+01  0.199059D+01 -0.590295D+01
      2   0.614392D+00 -0.437566D+01 -0.205833D+00 -0.590295D+01  0.375497D+01
      3   0.259529D+01 -0.205833D+00 -0.943341D+00 -0.100370D+01  0.384504D+01
                51            52            53            54            55 
      1  -0.100370D+01  0.168435D+01 -0.337904D+00 -0.127304D+01 -0.879366D+01
      2   0.384504D+01 -0.337904D+00  0.287896D+01 -0.178534D+00  0.165984D+01
      3  -0.204956D+00 -0.127304D+01 -0.178534D+00 -0.604889D+00 -0.439803D+01
                56            57            58            59            60 
      1   0.165984D+01 -0.439803D+01 -0.259991D+00  0.294805D+01 -0.561799D+00
      2   0.253360D+01  0.182781D+00  0.294805D+01  0.330994D+00 -0.228572D+01
      3   0.182781D+00 -0.525572D+00 -0.561799D+00 -0.228572D+01  0.106683D+01
                61            62            63            64            65 
      1  -0.318950D+01 -0.303587D+00 -0.626739D+00  0.100096D+02 -0.164075D+01
      2  -0.303587D+00 -0.157652D+01  0.131048D+01 -0.164075D+01 -0.143257D+01
      3  -0.626739D+00  0.131048D+01  0.522890D+00  0.501589D+01 -0.612589D+00
                66            67            68            69            70 
      1   0.501589D+01 -0.470608D+01 -0.558592D+00 -0.193528D+01  0.404066D+01
      2  -0.612589D+00 -0.558592D+00 -0.687054D+00  0.166251D+01  0.145293D-01
      3   0.232812D+01 -0.193528D+01  0.166251D+01 -0.701936D+00  0.229715D+01
                71            72            73            74            75 
      1   0.145293D-01  0.229715D+01 -0.103067D+02 -0.111612D+01 -0.511509D+01
      2   0.112934D+01 -0.281794D+00 -0.111612D+01  0.152246D+01 -0.465181D+00
      3  -0.281794D+00 -0.186271D+01 -0.511509D+01 -0.465181D+00 -0.235260D+01
                76            77            78            79            80 
      1  -0.421543D+01  0.778788D+00 -0.179139D+01 -0.403028D+01  0.138433D+00
      2   0.778788D+00 -0.798575D+00 -0.156069D+01  0.138433D+00 -0.113513D+01
      3  -0.179139D+01 -0.156069D+01 -0.600621D+00 -0.230603D+01 -0.183491D+00
                81            82            83            84            85 
      1  -0.230603D+01 -0.612711D+00  0.174637D+01  0.974529D+00  0.263157D+01
      2  -0.183491D+00  0.174637D+01  0.183918D+01 -0.125916D+01  0.451523D+01
      3   0.186569D+01  0.974529D+00 -0.125916D+01  0.135998D+01 -0.199610D+01
                86            87            88            89            90 
      1   0.451523D+01 -0.199610D+01  0.302811D+00 -0.116292D+01  0.219376D+01
      2   0.891408D+01 -0.525611D+01 -0.116292D+01 -0.313372D+01  0.102139D+01
      3  -0.525611D+01  0.124702D+01  0.219376D+01  0.102139D+01  0.844301D+00
                91            92            93            94            95 
      1  -0.130087D+01 -0.495920D+00 -0.245798D+01 -0.775239D+00 -0.230730D+01
      2  -0.495920D+00 -0.338626D+00  0.578101D+00 -0.230730D+01 -0.484474D+01
      3  -0.245798D+01  0.578101D+00 -0.160962D+01  0.627380D+00  0.488983D+01
                96            97            98            99           100 
      1   0.627380D+00 -0.300795D+01  0.125851D+01 -0.218193D+01  0.115123D+02
      2   0.488983D+01  0.125851D+01  0.650712D+01 -0.200965D+01 -0.232406D+01
      3  -0.959506D+00 -0.218193D+01 -0.200965D+01  0.213487D+00  0.343687D+01
               101           102           103           104           105 
      1  -0.232406D+01  0.343687D+01  0.212039D+00  0.101953D+01  0.329796D+00
      2   0.141679D+01 -0.596726D+00  0.101953D+01 -0.854833D+00  0.691250D+00
      3  -0.596726D+00  0.220283D+01  0.329796D+00  0.691250D+00 -0.212989D+00
               106           107           108           109           110 
      1   0.324992D+01 -0.643968D+00  0.257731D+01 -0.380723D+00 -0.835236D+00
      2  -0.643968D+00  0.635155D+00 -0.797529D+00 -0.835236D+00 -0.145870D+01
      3   0.257731D+01 -0.797529D+00  0.166795D+01  0.102484D+01  0.552925D+00
               111           112           113           114           115 
      1   0.102484D+01 -0.102889D+01 -0.182788D+00  0.103604D+00  0.123398D+01
      2   0.552925D+00 -0.182788D+00 -0.450910D+01  0.218255D+01 -0.230519D+00
      3  -0.862231D+00  0.103604D+00  0.218255D+01 -0.220983D+01  0.548134D-01
               116           117           118           119           120 
      1  -0.230519D+00  0.548134D-01  0.375247D+01 -0.262745D+01 -0.125623D+01
      2   0.197127D+01 -0.179634D+01 -0.262745D+01  0.274770D+01  0.649115D+00
      3  -0.179634D+01  0.227585D+01 -0.125623D+01  0.649115D+00  0.110597D+01
               121           122           123           124           125 
      1  -0.421824D+01  0.488878D+01  0.153256D+01 -0.156346D+01  0.130803D+01
      2   0.488878D+01 -0.728750D+01 -0.257877D+01  0.130803D+01 -0.202733D+01
      3   0.153256D+01 -0.257877D+01 -0.172947D+01  0.174818D+01 -0.180491D+01
               126           127           128           129           130 
      1   0.174818D+01  0.322585D+01  0.949654D+00 -0.169983D+01  0.216634D+01
      2  -0.180491D+01  0.949654D+00  0.115410D+01 -0.445287D+00  0.150378D+01
      3  -0.143646D+01 -0.169983D+01 -0.445287D+00  0.157698D+01 -0.848395D+00
               131           132           133           134           135 
      1   0.150378D+01 -0.848395D+00 -0.204467D+01 -0.160953D+00  0.159255D+01
      2   0.194889D+01 -0.144965D+01 -0.160953D+00 -0.118562D+01  0.749137D+00
      3  -0.144965D+01  0.169589D+01  0.159255D+01  0.749137D+00 -0.217219D+01
               136           137           138           139           140 
      1  -0.417906D+01 -0.278837D+01  0.135488D+01 -0.447258D+01 -0.488643D+01
      2  -0.278837D+01 -0.281569D+01  0.703499D+00 -0.488643D+01 -0.673627D+01
      3   0.135488D+01  0.703499D+00 -0.118060D+01  0.158793D+01  0.248292D+01
               141           142           143           144           145 
      1   0.158793D+01  0.168255D+01  0.132660D+01 -0.182767D+01 -0.305813D+01
      2   0.248292D+01  0.132660D+01  0.191573D+01 -0.173003D+01  0.970617D+00
      3  -0.168192D+01 -0.182767D+01 -0.173003D+01  0.143953D+01  0.164283D+01
               146           147           148           149           150 
      1   0.970617D+00  0.164283D+01  0.217531D+01 -0.155461D+01 -0.856810D+00
      2  -0.115381D+01 -0.453269D+00 -0.155461D+01  0.213507D+01  0.150636D+01
      3  -0.453269D+00 -0.150134D+01 -0.856810D+00  0.150636D+01  0.176052D+01
               151           152           153           154           155 
      1   0.202991D+01 -0.196207D+00 -0.155664D+01 -0.116745D+02 -0.192922D+01
      2  -0.196207D+00  0.120066D+01  0.815542D+00 -0.192922D+01 -0.126774D+01
      3  -0.155664D+01  0.815542D+00  0.216485D+01 -0.344599D+01 -0.479867D+00
               156           157           158           159           160 
      1  -0.344599D+01  0.621681D+00 -0.980610D+00  0.447111D+00 -0.330905D+01
      2  -0.479867D+00 -0.980610D+00 -0.713743D+00 -0.685861D+00 -0.531921D+00
      3  -0.221234D+01  0.447111D+00 -0.685861D+00 -0.118643D+00 -0.261383D+01
               161           162           163           164           165 
      1  -0.531921D+00 -0.261383D+01  0.270888D+00 -0.785732D+00 -0.999032D+00
      2  -0.586189D+00 -0.687386D+00 -0.785732D+00  0.133544D+01  0.501948D+00
      3  -0.687386D+00 -0.167130D+01 -0.999032D+00  0.501948D+00  0.765207D+00
               166           167           168           169           170 
      1  -0.104243D+01  0.664533D-01  0.524149D-01 -0.125863D+01 -0.261362D+00
      2   0.664533D-01 -0.458795D+01 -0.220818D+01 -0.261362D+00 -0.194906D+01
      3   0.524149D-01 -0.220818D+01 -0.224380D+01 -0.132809D+00 -0.179088D+01
               171           172           173           174           175 
      1  -0.132809D+00 -0.250612D+01  0.176579D+01  0.608342D-01  0.380911D+01
      2  -0.179088D+01  0.176579D+01 -0.238919D+01  0.401924D+00 -0.142029D+01
      3  -0.227143D+01  0.608342D-01  0.401924D+00 -0.459230D+00  0.149564D+01
               176           177           178           179           180 
      1  -0.142029D+01  0.149564D+01  0.179803D+01  0.477672D+00  0.286409D+00
      2   0.353778D+01 -0.197611D+00  0.477672D+00  0.149715D+00  0.701553D+00
      3  -0.197611D+00  0.125773D+01  0.286409D+00  0.701553D+00 -0.214747D+00
               181           182           183           184           185 
      1   0.147829D+01  0.379827D+00  0.238795D+00 -0.100447D+00 -0.686709D+00
      2   0.379827D+00 -0.602862D+00  0.396971D-01 -0.686709D+00  0.112111D+00
      3   0.238795D+00  0.396971D-01  0.812403D+00  0.305416D-01 -0.806215D+00
               186           187           188           189           190 
      1   0.305416D-01 -0.203592D+01 -0.245424D+00 -0.146595D+01  0.156257D+01
      2  -0.806215D+00 -0.245424D+00 -0.110662D+01  0.701273D+00  0.155232D-01
      3   0.132627D+00 -0.146595D+01  0.701273D+00 -0.750002D+01 -0.672397D+00
               191           192           193           194           195 
      1   0.155232D-01 -0.672397D+00 -0.191303D+01  0.827783D+00 -0.307896D-01
      2   0.227709D+01 -0.110020D+01  0.827783D+00 -0.626791D+01  0.100323D+01
      3  -0.110020D+01  0.760371D+00 -0.307896D-01  0.100323D+01 -0.112713D+01
               196           197           198           199           200 
      1  -0.986575D+00 -0.963514D+00  0.687145D+00 -0.390033D+00  0.242472D+00
      2  -0.963514D+00 -0.827100D+00 -0.200490D+00  0.242472D+00  0.731343D+00
      3   0.687145D+00 -0.200490D+00  0.308128D+00  0.469750D+00 -0.391033D+00
               201           202           203           204           205 
      1   0.469750D+00  0.617968D+00  0.116004D+01 -0.488010D+00  0.153676D+01
      2  -0.391033D+00  0.116004D+01  0.193630D+00  0.109441D+00  0.546039D+00
      3   0.317252D+00 -0.488010D+00  0.109441D+00  0.674452D+00 -0.344553D+00
               206           207           208           209           210 
      1   0.546039D+00 -0.344553D+00 -0.165953D+01 -0.634603D-01  0.619113D+00
      2   0.150010D+01 -0.149347D+01 -0.634603D-01 -0.254683D+01 -0.116737D+01
      3  -0.149347D+01  0.735553D+01  0.619113D+00 -0.116737D+01 -0.807365D+00
               211           212           213           214           215 
      1  -0.192519D+01 -0.101705D+01 -0.101743D+00  0.905654D+00 -0.964134D+00
      2  -0.101705D+01 -0.607870D+01 -0.940191D+00 -0.964134D+00  0.922495D+00
      3  -0.101743D+00 -0.940191D+00 -0.108937D+01 -0.695005D+00 -0.168858D+00
               216           217           218           219           220 
      1  -0.695005D+00  0.430145D+00  0.140055D+00 -0.507546D+00  0.493560D+00
      2  -0.168858D+00  0.140055D+00 -0.737136D+00 -0.373744D+00 -0.117980D+01
      3  -0.302816D+00 -0.507546D+00 -0.373744D+00 -0.290531D+00 -0.468292D+00
               221           222           223           224           225 
      1  -0.117980D+01 -0.468292D+00 -0.148893D+01  0.547256D+00  0.275404D+00
      2   0.322663D+00 -0.738120D-01  0.547256D+00 -0.155123D+01 -0.151708D+01
      3  -0.738120D-01  0.676727D+00  0.275404D+00 -0.151708D+01 -0.735324D+01
               226           227           228           229           230 
      1   0.281459D+01  0.181230D+01  0.174333D-01  0.380533D+01  0.132510D+01
      2   0.181230D+01  0.238443D+01  0.409016D+00  0.132510D+01  0.331759D+01
      3   0.174333D-01  0.409016D+00  0.509970D+00  0.150007D+01  0.115447D+00
               231           232           233           234           235 
      1   0.150007D+01 -0.175284D+01  0.547143D+00 -0.256501D+00 -0.143999D+01
      2   0.115447D+00  0.547143D+00 -0.192845D+00  0.712923D+00  0.496936D+00
      3   0.123595D+01 -0.256501D+00  0.712923D+00  0.214811D+00 -0.233387D+00
               236           237           238           239           240 
      1   0.496936D+00 -0.233387D+00  0.199752D-01  0.672161D+00  0.743328D-01
      2   0.569473D+00  0.837910D-01  0.672161D+00  0.278497D-01  0.800499D+00
      3   0.837910D-01 -0.806539D+00  0.743328D-01  0.800499D+00  0.167298D+00
               241           242           243           244           245 
      1   0.201161D+01 -0.284942D+00  0.149434D+01  0.123125D+01 -0.443819D+00
      2  -0.284942D+00  0.112903D+01  0.636938D+00 -0.443819D+00  0.161762D+00
      3   0.149434D+01  0.636938D+00  0.749611D+01  0.249832D+01  0.249943D+00
               246           247           248           249           250 
      1   0.249832D+01 -0.634345D+00  0.214002D+01  0.301059D+00  0.310060D+01
      2   0.249943D+00  0.214002D+01 -0.506140D+01 -0.492961D+01  0.832764D+00
      3   0.156470D+01  0.301059D+00 -0.492961D+01 -0.102872D+01  0.208923D+01
               251           252           253           254           255 
      1   0.832764D+00  0.208923D+01  0.863725D+00  0.143282D+01 -0.111322D+01
      2  -0.660312D+01 -0.210210D+01  0.143282D+01 -0.156468D+01 -0.969857D+00
      3  -0.210210D+01 -0.213449D+00 -0.111322D+01 -0.969857D+00 -0.129981D+01
               256           257           258           259           260 
      1   0.220424D+01 -0.428110D+01 -0.171067D+01 -0.399145D+00 -0.100319D+01
      2  -0.428110D+01  0.937209D+01  0.538187D+01 -0.100319D+01  0.323444D+01
      3  -0.171067D+01  0.538187D+01  0.130117D+01 -0.214488D+01  0.111472D+01
               261           262           263           264           265 
      1  -0.214488D+01  0.560105D+01  0.729863D+00 -0.267342D+01 -0.510564D-01
      2   0.111472D+01  0.729863D+00  0.258378D+01 -0.621575D+00  0.163376D+00
      3  -0.842890D+00 -0.267342D+01 -0.621575D+00  0.209272D+01  0.457530D+00
               266           267           268           269           270 
      1   0.163376D+00  0.457530D+00 -0.170255D+01  0.208239D+00  0.120100D+01
      2  -0.109603D+01  0.669443D+00  0.208239D+00  0.432232D+00  0.775602D-02
      3   0.669443D+00 -0.419108D+00  0.120100D+01  0.775602D-02 -0.185361D+01
               271           272           273           274           275 
      1  -0.486646D+00 -0.592526D+00 -0.740714D+00  0.125059D+00 -0.923621D+00
      2  -0.592526D+00 -0.248664D+01  0.115705D+01 -0.923621D+00 -0.217718D+00
      3  -0.740714D+00  0.115705D+01 -0.214525D+01  0.438385D+00 -0.183513D+00
               276           277           278           279           280 
      1   0.438385D+00 -0.109126D+01 -0.998155D-01 -0.514047D+00  0.426318D+01
      2  -0.183513D+00 -0.998155D-01 -0.167408D+01  0.135347D+01  0.124945D+01
      3   0.488106D+00 -0.514047D+00  0.135347D+01 -0.588763D+01  0.166246D+01
               281           282           283           284           285 
      1   0.124945D+01  0.166246D+01  0.531874D+00  0.126805D+01  0.985544D-01
      2   0.213908D+01  0.427541D+00  0.126805D+01  0.981142D+00  0.298596D+00
      3   0.427541D+00  0.150784D+01  0.985544D-01  0.298596D+00  0.273088D+00
               286           287           288           289           290 
      1   0.270535D+01  0.503285D+00  0.182354D+01  0.103086D+01  0.179092D+01
      2   0.503285D+00  0.872744D+00  0.989935D+00  0.179092D+01  0.130953D+01
      3   0.182354D+01  0.989935D+00  0.220087D+01 -0.417455D+00 -0.582072D+00
               291           292           293           294           295 
      1  -0.417455D+00  0.155833D+01  0.189170D+01 -0.671512D+00 -0.445822D+00
      2  -0.582072D+00  0.189170D+01  0.978715D+01 -0.318131D+01 -0.145389D+01
      3   0.497532D+00 -0.671512D+00 -0.318131D+01  0.204639D+01  0.105180D+01
               296           297           298           299           300 
      1  -0.145389D+01  0.105180D+01 -0.809488D+00  0.170295D+01  0.366959D+00
      2  -0.561062D+01  0.334650D+01  0.170295D+01 -0.102576D+01 -0.456792D+00
      3   0.334650D+01 -0.261814D+01  0.366959D+00 -0.456792D+00 -0.405775D+00
               301           302           303           304           305 
      1   0.144432D+01 -0.159716D+01 -0.546561D+00  0.326993D+00 -0.121951D+01
      2  -0.159716D+01  0.999622D+01  0.323002D+01 -0.121951D+01  0.572816D+01
      3  -0.546561D+00  0.323002D+01  0.206548D+01 -0.902092D+00  0.338866D+01
               306           307           308           309           310 
      1  -0.902092D+00 -0.412791D+01  0.128359D+01 -0.163713D+01  0.605169D+00
      2   0.338866D+01  0.128359D+01 -0.220308D+01  0.488441D+00 -0.130214D+01
      3   0.261607D+01 -0.163713D+01  0.488441D+00 -0.149413D+01  0.157651D+00
               311           312           313           314           315 
      1  -0.130214D+01  0.157651D+00 -0.265741D+01  0.582863D+00 -0.177787D+01
      2   0.119361D+01 -0.324012D+00  0.582863D+00 -0.919550D+00  0.106896D+01
      3  -0.324012D+00  0.339418D+00 -0.177787D+01  0.106896D+01 -0.220086D+01
               316           317           318           319           320 
      1  -0.552779D+01  0.854800D+00  0.266282D+01  0.178621D+00 -0.246889D+00
      2   0.854800D+00 -0.270143D+01 -0.770905D+00 -0.246889D+00 -0.959439D+00
      3   0.266282D+01 -0.770905D+00 -0.211151D+01  0.309338D+00 -0.654940D+00
               321           322           323           324           325 
      1   0.309338D+00  0.172036D+01  0.111495D+00 -0.120164D+01  0.446759D+00
      2  -0.654940D+00  0.111495D+00 -0.444355D+00  0.630180D-01 -0.460584D+00
      3  -0.324697D+00 -0.120164D+01  0.630180D-01  0.185674D+01  0.810757D+00
               326           327           328           329           330 
      1  -0.460584D+00  0.810757D+00  0.187314D+00  0.926967D+00  0.410519D+00
      2   0.251971D+01  0.112879D+01  0.926967D+00 -0.411343D+00  0.113961D+00
      3   0.112879D+01  0.216420D+01  0.410519D+00  0.113961D+00  0.393946D+00
               331           332           333 
      1   0.108169D+01 -0.727561D-01  0.575377D+00
      2  -0.727561D-01  0.167643D+01  0.132807D+01
      3   0.575377D+00  0.132807D+01  0.588193D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.326350D-01  0.216686D+01 -0.298268D+01  0.323997D+01  0.587018D+01
      2   0.226891D+01 -0.116402D+00  0.988102D+01 -0.640863D+00 -0.124726D+02
      3  -0.324673D+01 -0.104507D+02 -0.185910D+01 -0.631507D+01  0.519166D+01
                 6             7             8             9            10 
      1  -0.255734D+01 -0.261622D+00 -0.732479D+00 -0.785746D+00 -0.416583D+01
      2  -0.355030D+01  0.251980D+01  0.735595D+00  0.337308D+00  0.102986D+02
      3   0.946810D+01 -0.141979D+01  0.103074D+02  0.349060D+01  0.436033D+01
                11            12            13            14            15 
      1   0.476828D+01  0.518927D-01  0.463242D+01 -0.115155D+01 -0.780502D+01
      2  -0.377622D+01  0.429694D+01 -0.521011D+01  0.176192D+00  0.621811D+01
      3   0.651205D+01  0.751582D+01  0.999828D+01 -0.594849D+01 -0.643499D+01
                16            17            18            19            20 
      1  -0.128923D+01 -0.146575D+01 -0.326807D+00  0.128072D+00 -0.133460D+01
      2   0.160452D+01  0.786595D+00 -0.344689D+00 -0.135404D+02 -0.657485D+01
      3   0.816858D+01 -0.676361D+01 -0.333873D+01 -0.154870D+02 -0.126792D+02
                21            22            23            24            25 
      1   0.633160D+01  0.712490D+01  0.211452D+02 -0.520389D+01  0.125061D+02
      2   0.102142D+00 -0.331663D+01  0.463978D+01 -0.564611D+01 -0.117516D+02
      3   0.411625D+01  0.619136D+01  0.224580D+02 -0.749578D+01  0.304324D+01
                26            27            28            29            30 
      1   0.167768D+02 -0.209208D+02 -0.185175D+00 -0.365405D+01  0.316509D-01
      2  -0.107930D+02  0.120877D+02 -0.344876D+01  0.263500D+00  0.183136D+00
      3  -0.164388D+01  0.571545D+00 -0.930228D-03 -0.141011D+01 -0.389594D-01
                31            32            33            34            35 
      1  -0.173302D+01  0.195072D+00  0.323893D+00 -0.889747D-01 -0.305617D+00
      2   0.658660D-01  0.124639D+01 -0.296145D-03  0.767601D+00  0.129284D+00
      3  -0.354211D+00 -0.115529D-01  0.142427D+01  0.518850D-01  0.746821D+00
                36            37            38            39            40 
      1   0.857190D-01 -0.485554D+00 -0.197915D+01 -0.648667D+01  0.638243D+01
      2  -0.431495D+00 -0.130363D+02  0.739398D+01  0.624537D+00  0.384605D+01
      3  -0.243047D-01  0.150555D+02 -0.143331D+02 -0.440011D+01  0.452377D+01
                41            42            43            44            45 
      1  -0.211651D+02 -0.465822D+01 -0.121832D+02  0.178272D+02  0.213795D+02
      2   0.507790D+01  0.584704D+01 -0.106933D+02  0.104862D+02  0.111100D+02
      3  -0.220884D+02 -0.729474D+01 -0.310046D+01 -0.142048D+01 -0.576549D+00
                46            47            48            49            50 
      1   0.503099D+01  0.475582D+01 -0.232203D+00  0.467936D+01  0.745244D+00
      2   0.104706D+02  0.312380D+01  0.404216D+01  0.454434D+01 -0.217307D+00
      3  -0.365193D+01  0.688303D+01 -0.779920D+01  0.103891D+02  0.519882D+01
                51            52            53            54            55 
      1  -0.806869D+01  0.128099D+01 -0.156455D+01  0.328222D+00  0.333014D+00
      2  -0.606556D+01  0.149670D+01 -0.794459D+00 -0.343767D+00  0.228486D+01
      3  -0.610257D+01 -0.844882D+01 -0.642480D+01  0.336105D+01  0.257246D+01
                56            57            58            59            60 
      1   0.187004D+01  0.328034D+01  0.298194D+01 -0.664240D+01 -0.254557D+01
      2  -0.601082D+00  0.988331D+01 -0.107780D+00 -0.122060D+02  0.324449D+01
      3  -0.107552D+02  0.227446D+01 -0.661994D+01 -0.442902D+01  0.937438D+01
                61            62            63            64            65 
      1   0.328159D+00 -0.779287D+00  0.783074D+00 -0.667419D+01 -0.100090D+02
      2   0.247059D+01 -0.798904D+00  0.286440D+00  0.183700D+02 -0.203929D+01
      3   0.187483D+01  0.102430D+02 -0.350015D+01  0.104215D+02  0.889849D+01
                66            67            68            69            70 
      1  -0.516266D+01 -0.166391D+02  0.272699D+01 -0.683755D+01 -0.269969D+01
      2   0.268311D+00  0.516192D+01  0.550313D+01  0.501709D+01 -0.254721D+02
      3   0.428054D+01  0.265913D+02 -0.288694D+01  0.725667D+01 -0.319150D+00
                71            72            73            74            75 
      1   0.230734D+01 -0.217569D+00  0.633985D+01 -0.103080D+02  0.491096D+01
      2   0.278122D+01 -0.248481D+02  0.180478D+02  0.197108D+01 -0.162174D+00
      3   0.389412D+01  0.774144D+00 -0.894391D+01  0.944742D+01 -0.400507D+01
                76            77            78            79            80 
      1  -0.172902D+02 -0.136740D+01 -0.727930D+01  0.174949D+01  0.210221D+01
      2  -0.490245D+01  0.575987D+01 -0.472071D+01 -0.256509D+02 -0.182516D+01
      3   0.271680D+02  0.138969D+01  0.745418D+01  0.384422D+00  0.389019D+01
                81            82            83            84            85 
      1  -0.844466D+00 -0.493937D+01  0.318729D+01  0.179197D+01  0.146245D+01
      2  -0.248534D+02 -0.140950D+02 -0.133622D+02  0.133458D+02 -0.467632D+01
      3  -0.789030D+00 -0.193849D+02 -0.216567D+02  0.141947D+02 -0.294354D+01
                86            87            88            89            90 
      1   0.142059D+02  0.379086D+01  0.790162D+01  0.224620D+02 -0.141075D+02
      2  -0.837510D-01 -0.398981D+01 -0.250190D+01 -0.132143D+02  0.113156D+02
      3   0.108730D+02  0.260369D+00  0.749216D+01 -0.151345D+01  0.281349D+01
                91            92            93            94            95 
      1   0.826737D+01  0.326954D+01  0.727144D+01  0.456572D+01 -0.955377D+01
      2  -0.206201D+01  0.101307D+01 -0.302938D+00 -0.949025D-02  0.265912D+01
      3  -0.727209D+01 -0.134503D+01 -0.636904D+01  0.488506D+01  0.870058D+00
                96            97            98            99           100 
      1  -0.528317D+01  0.559584D+01 -0.298855D+01  0.165076D+01  0.897950D+00
      2  -0.484244D+00 -0.363298D+01  0.393361D+00 -0.444993D+00 -0.365796D+01
      3  -0.723197D+01 -0.113276D+02 -0.765430D+01 -0.618624D+01 -0.824288D+01
               101           102           103           104           105 
      1   0.204413D+01  0.292369D+01 -0.351393D+00  0.114179D+01 -0.111450D+01
      2   0.176229D+01  0.472251D+01 -0.219762D+01  0.196241D+01 -0.167125D+01
      3  -0.402308D+01 -0.349497D+01 -0.623290D+00 -0.396655D+00 -0.178254D+01
               106           107           108           109           110 
      1   0.211019D+01  0.104751D+01  0.142393D+01  0.142883D+01 -0.145324D+01
      2   0.208757D+01 -0.489945D+00  0.249691D+01  0.502325D+01  0.241752D+01
      3  -0.141876D+01 -0.282698D+01 -0.101231D+01  0.542577D+01  0.572278D+01
               111           112           113           114           115 
      1  -0.191651D+01 -0.340838D+00 -0.145274D+01 -0.309083D+01 -0.303922D+00
      2  -0.368479D+01  0.152665D+01  0.679228D+01 -0.649654D+01 -0.327574D+01
      3  -0.367115D+01  0.500256D+01  0.131407D+02 -0.668588D+01 -0.182750D+01
               116           117           118           119           120 
      1   0.178078D+00  0.223538D+01 -0.772636D+00 -0.264805D+00  0.217322D+01
      2  -0.499741D+01  0.615871D+01 -0.101681D+01  0.660490D+00  0.371619D+01
      3  -0.555300D+01  0.585095D+01  0.257096D+00 -0.377920D+01  0.394221D-01
               121           122           123           124           125 
      1  -0.288541D+01  0.298331D+01 -0.236962D+01  0.125944D+01 -0.464391D+00
      2  -0.329698D+01 -0.322761D+00 -0.354521D+01  0.868500D+00 -0.287521D+01
      3  -0.375693D+00  0.908888D+01  0.390893D+01  0.177062D+01  0.251155D+01
               126           127           128           129           130 
      1  -0.145487D+01 -0.441460D+01 -0.180161D+01  0.281057D+01 -0.290741D+01
      2  -0.220855D+01 -0.229776D+01  0.261953D+00  0.381479D+01  0.872426D+00
      3   0.101553D+01 -0.767517D+01 -0.627999D+01  0.445054D+01 -0.682569D+01
               131           132           133           134           135 
      1  -0.590970D+01  0.388906D+01  0.275556D+01  0.445179D+01 -0.432346D+01
      2  -0.344193D+01  0.565646D+01  0.124610D+01  0.257820D+01 -0.490494D+01
      3  -0.113885D+02  0.615862D+01  0.411828D+01  0.438641D+01 -0.583840D+01
               136           137           138           139           140 
      1   0.592173D+00 -0.445927D+00 -0.210397D+01 -0.289808D+01 -0.285659D+01
      2  -0.931136D+00 -0.619969D+00  0.396386D+01  0.345494D+01 -0.314006D+00
      3  -0.450412D+00 -0.415423D+01  0.131089D+00 -0.754201D+00 -0.888586D+01
               141           142           143           144           145 
      1  -0.212393D+01 -0.123159D+01 -0.283095D+00  0.135869D+01  0.410616D+01
      2   0.347833D+01  0.104539D+01  0.285066D+01 -0.227298D+01 -0.252445D+01
      3   0.390944D+01 -0.166007D+01  0.258725D+01 -0.102048D+01  0.712309D+01
               146           147           148           149           150 
      1  -0.176056D+01 -0.247772D+01 -0.287403D+01  0.595917D+01  0.374217D+01
      2  -0.234334D+00  0.368824D+01 -0.795028D+00 -0.364607D+01 -0.597624D+01
      3  -0.613527D+01 -0.417673D+01 -0.665734D+01  0.119654D+02  0.634500D+01
               151           152           153           154           155 
      1  -0.250523D+01  0.444688D+01  0.408939D+01 -0.981603D+00  0.196282D+01
      2   0.124007D+01 -0.282462D+01 -0.507376D+01 -0.357385D+01 -0.160521D+01
      3  -0.391829D+01  0.456940D+01  0.583165D+01  0.801635D+01 -0.434746D+01
               156           157           158           159           160 
      1  -0.276460D+01 -0.264227D+00 -0.112946D+01 -0.924454D+00 -0.196661D+01
      2   0.492114D+01  0.245450D+01  0.198668D+01  0.150909D+01  0.219392D+01
      3   0.341480D+01 -0.944404D+00  0.602225D+00 -0.193275D+01  0.128975D+01
               161           162           163           164           165 
      1   0.115747D+01 -0.131779D+01 -0.128125D+01 -0.142819D+01  0.163278D+01
      2   0.348335D+00  0.256524D+01  0.494340D+01 -0.229069D+01 -0.347949D+01
      3  -0.289185D+01  0.101243D+01 -0.501846D+01  0.539405D+01  0.338767D+01
               166           167           168           169           170 
      1  -0.273232D+00  0.183528D+01 -0.288878D+01  0.179477D+00  0.386132D+00
      2  -0.146469D+01  0.689755D+01  0.678163D+01 -0.307462D+01  0.511824D+01
      3   0.469326D+01 -0.136224D+02 -0.684532D+01  0.159316D+01 -0.562298D+01
               171           172           173           174           175 
      1  -0.196522D+01 -0.226607D+01  0.292861D+01 -0.223527D+00  0.450672D+01
      2   0.623495D+01 -0.183756D+01  0.188332D+01  0.193392D+01  0.543274D+01
      3  -0.584543D+01  0.289573D+01 -0.504700D+01  0.342412D+00 -0.419294D+01
               176           177           178           179           180 
      1  -0.767406D+01  0.244792D+00  0.143930D+01 -0.622651D+00 -0.332412D+00
      2  -0.167878D+01  0.117898D+00  0.378442D+01 -0.110705D+01  0.899892D+00
      3   0.105061D+02 -0.145637D+01 -0.708134D+00  0.216300D+01  0.541346D+00
               181           182           183           184           185 
      1  -0.209788D+01 -0.817056D+00 -0.940338D+00  0.204971D-01 -0.675351D+00
      2   0.267297D+00  0.836820D+00 -0.352900D+01 -0.649457D+00  0.192046D+01
      3   0.166546D+01  0.315795D-01  0.392344D+00  0.659488D+00  0.652775D+00
               186           187           188           189           190 
      1   0.762804D+00  0.103302D+01  0.287449D+01 -0.478390D+00  0.568403D+00
      2  -0.498107D+00  0.261377D+00 -0.243279D+01  0.164022D+02 -0.310503D+01
      3  -0.170525D+01 -0.141720D+01 -0.251466D+01  0.172497D+01 -0.396014D+01
               191           192           193           194           195 
      1   0.486317D+01 -0.952885D+00  0.119205D+01 -0.748595D+01 -0.120804D+01
      2   0.220489D+01  0.117175D+00  0.276952D+01 -0.336787D+01  0.138938D+01
      3   0.499130D+01 -0.170523D+01  0.557011D+01 -0.927279D+01  0.143533D+01
               196           197           198           199           200 
      1  -0.800288D+00 -0.355508D+01  0.167455D+00  0.445479D+00 -0.138815D+01
      2  -0.318274D-01  0.826421D+00 -0.730243D+00 -0.179162D+01  0.423966D+00
      3   0.105569D+01 -0.136730D+01 -0.690677D+00 -0.114366D+01 -0.101570D+01
               201           202           203           204           205 
      1   0.138654D+01 -0.850980D+00 -0.173813D+00  0.305376D+01 -0.276488D+00
      2  -0.116796D+01 -0.923838D+00 -0.140970D+01 -0.614646D+00 -0.313302D+01
      3  -0.124335D+01 -0.365631D+00 -0.113799D+01  0.127346D+01 -0.284975D+01
               206           207           208           209           210 
      1  -0.953006D+00  0.134922D+02 -0.420828D+00  0.511194D+01  0.881127D+00
      2   0.138882D+01 -0.935059D+01 -0.333777D+01 -0.242205D+01  0.363744D-01
      3   0.152965D+00 -0.150654D+01  0.448830D+01  0.518340D+01  0.174836D+01
               211           212           213           214           215 
      1   0.140861D+01  0.705470D+01 -0.131929D+01  0.643579D+00 -0.364511D+01
      2  -0.283474D+01 -0.345250D+01 -0.133701D+01 -0.775246D-01 -0.660237D+00
      3   0.579824D+01  0.880475D+01  0.134944D+01 -0.112321D+01 -0.132539D+01
               216           217           218           219           220 
      1  -0.199323D+00 -0.619088D+00 -0.138278D+01 -0.130817D+01 -0.771488D+00
      2  -0.726284D+00 -0.174498D+01 -0.349886D+00 -0.108609D+01  0.975172D+00
      3   0.686453D+00  0.108834D+01 -0.101156D+01  0.130176D+01 -0.362569D+00
               221           222           223           224           225 
      1   0.210447D+00  0.311017D+01  0.947832D-01 -0.105067D+01 -0.138827D+02
      2  -0.144787D+01  0.517763D+00 -0.318327D+01 -0.122166D+01 -0.874921D+01
      3   0.120149D+01  0.121608D+01  0.285428D+01  0.325681D-01  0.152577D+01
               226           227           228           229           230 
      1   0.245571D+01  0.310029D+01  0.276174D+00  0.448010D+01  0.729152D+01
      2  -0.223068D+01 -0.204215D+01  0.195147D+01 -0.559734D+01 -0.171003D+01
      3  -0.324368D+01 -0.538860D+01 -0.350464D+00 -0.450146D+01 -0.101145D+02
               231           232           233           234           235 
      1   0.218315D+00 -0.130885D+01 -0.502049D+00  0.356384D+00  0.205858D+01
      2  -0.190678D+00  0.389219D+01  0.967754D+00  0.891289D+00  0.173992D+00
      3  -0.142062D+01  0.822718D+00  0.212937D+01 -0.535157D+00 -0.162980D+01
               236           237           238           239           240 
      1  -0.903537D+00  0.824240D+00 -0.119915D-01  0.793511D+00  0.747257D+00
      2  -0.718990D+00 -0.354542D+01  0.731511D+00  0.189727D+01  0.616345D+00
      3   0.752323D-01 -0.467119D+00  0.706711D+00 -0.679665D+00 -0.168650D+01
               241           242           243           244           245 
      1  -0.893142D+00  0.300905D+01  0.118211D+01 -0.797337D+01  0.399846D+01
      2   0.413990D+00  0.228973D+01  0.163565D+02 -0.173737D+01 -0.980344D+00
      3   0.130938D+01 -0.257589D+01 -0.172062D+01  0.742742D+01 -0.170907D+01
               246           247           248           249           250 
      1  -0.750712D+01  0.533839D+01  0.928739D+01 -0.492433D+01 -0.587302D+01
      2   0.481919D-01 -0.179639D-01  0.228372D+01  0.712383D+00 -0.338896D+01
      3   0.604580D+01  0.451189D+01 -0.102025D+01 -0.750438D+01  0.109814D+02
               251           252           253           254           255 
      1  -0.274382D+01 -0.166149D+01  0.451084D+01  0.294329D+01 -0.103072D+01
      2  -0.111524D+00 -0.369917D+00 -0.134524D+02  0.137962D+02  0.135456D+02
      3  -0.815999D+01  0.617882D+01  0.182182D+02 -0.229235D+02 -0.141495D+02
               256           257           258           259           260 
      1   0.813608D+00 -0.144042D+02  0.401275D+01 -0.699046D+01  0.233347D+02
      2   0.521230D+01 -0.265592D+00  0.320913D+01 -0.162497D+01  0.122661D+02
      3  -0.421258D+01 -0.973716D+01  0.905078D+00 -0.751316D+01 -0.116748D+01
               261           262           263           264           265 
      1   0.145463D+02  0.552369D+01 -0.347283D+01 -0.389794D+01 -0.183470D+01
      2   0.106480D+02  0.741170D+01  0.680325D+00 -0.161330D+01 -0.237927D+01
      3  -0.279105D+01  0.127172D+02 -0.293863D+01 -0.570689D+01 -0.343483D+01
               266           267           268           269           270 
      1   0.279461D+01  0.335740D-01 -0.323051D+01  0.121508D+01  0.297624D+01
      2  -0.921261D+00  0.837682D+00 -0.885862D+00  0.243634D+00  0.353786D+00
      3   0.202752D+01  0.177693D+01 -0.263144D+01 -0.887628D-01  0.314894D+01
               271           272           273           274           275 
      1   0.135170D+01  0.821127D+00  0.397988D+01 -0.582442D+00  0.275218D+00
      2  -0.144292D+01  0.323546D+01 -0.509202D+01  0.128257D+01  0.519278D+00
      3  -0.473088D+00  0.302345D+01 -0.332250D+01  0.189739D+01  0.100033D+01
               276           277           278           279           280 
      1  -0.398161D+00  0.808713D+00  0.206954D+00  0.950869D+01 -0.688988D+01
      2  -0.203257D+00 -0.284329D+01  0.227211D+01 -0.836282D+01  0.256693D+01
      3   0.372913D+00 -0.135607D+01  0.211426D+01 -0.249833D+01  0.143250D+02
               281           282           283           284           285 
      1  -0.142548D+01 -0.552707D+01 -0.474386D+00 -0.125424D+01 -0.860219D+00
      2   0.567790D+00  0.363918D+01  0.693127D-01  0.520308D+00  0.958639D-01
      3  -0.733619D+00  0.587815D+01 -0.514579D-01  0.481870D+01 -0.313258D+00
               286           287           288           289           290 
      1  -0.648054D+01 -0.905771D+00 -0.884430D+01  0.628941D-01  0.294437D+00
      2   0.134816D+01  0.138103D+01  0.342067D+01  0.181900D+00  0.354072D+00
      3   0.984189D+01 -0.281881D+00  0.517729D+01  0.214139D+01  0.372596D+01
               291           292           293           294           295 
      1  -0.174804D+01  0.163783D+01  0.353984D+01 -0.696533D+01 -0.144094D+01
      2   0.745615D+00  0.250497D+00 -0.171284D+01  0.169920D+01 -0.810990D+00
      3  -0.108465D+01  0.507275D+01 -0.312016D+01  0.167619D+00 -0.728354D+00
               296           297           298           299           300 
      1  -0.147717D+01  0.680608D+01  0.211440D-01  0.115143D+00  0.146518D+01
      2   0.158823D+01 -0.170779D+01  0.151261D+00 -0.442312D+00  0.604528D+00
      3   0.403886D+01  0.234608D+00 -0.174258D+01  0.394426D+01  0.109207D+01
               301           302           303           304           305 
      1   0.146519D+01 -0.368998D+01 -0.710664D+01  0.133522D+01 -0.161026D+01
      2  -0.397285D+00 -0.151841D+01 -0.141644D+01 -0.939437D+00 -0.147865D+01
      3   0.529051D+01  0.271705D+01  0.115794D+00  0.905463D+00  0.400073D+01
               306           307           308           309           310 
      1  -0.687399D+01  0.689616D+01 -0.170516D+01  0.563570D+01 -0.723031D+00
      2  -0.140441D+01  0.223172D+01 -0.582659D+00  0.338158D+01 -0.121577D+00
      3  -0.235801D+00 -0.143440D+02 -0.300670D+00 -0.588403D+01  0.379334D+00
               311           312           313           314           315 
      1   0.137221D+01 -0.111891D+01  0.647828D+01 -0.124891D+01  0.898369D+01
      2   0.488193D+00 -0.212633D+00  0.996022D+00 -0.138183D+01  0.302316D+01
      3  -0.480051D+01 -0.509618D-01 -0.983934D+01  0.161989D+00 -0.517453D+01
               316           317           318           319           320 
      1  -0.541361D+01 -0.338075D+01  0.381882D+01 -0.161483D+01 -0.259957D+01
      2   0.770591D+01 -0.912506D+00 -0.182098D+01  0.206964D+01 -0.873129D+00
      3  -0.129718D+02 -0.244265D+01  0.579022D+01 -0.294789D+01 -0.176170D+01
               321           322           323           324           325 
      1  -0.173066D+00  0.323551D+01  0.105532D+01 -0.296406D+01 -0.140546D+01
      2  -0.759473D+00 -0.105436D+01 -0.259531D+00  0.475336D+00 -0.155082D+01
      3   0.152767D+01  0.263057D+01 -0.200710D+00 -0.314536D+01  0.685287D+00
               326           327           328           329           330 
      1   0.713623D+00 -0.421498D+01 -0.594012D+00 -0.240912D+00 -0.194788D+00
      2  -0.318013D+01 -0.488333D+01 -0.118052D+01  0.731868D+00  0.430631D+00
      3   0.294763D+01  0.333130D+01  0.182071D+01 -0.120684D+01  0.227597D+00
               331           332           333 
      1  -0.912304D+00  0.138947D+00 -0.985254D+01
      2  -0.287729D+01 -0.216285D+01 -0.791963D+01
      3   0.141878D+01  0.206753D+01  0.249011D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.457232D+02 -0.788873D+01 -0.259631D+02 -0.241025D+01  0.188424D+02
      2   0.290649D+02  0.936607D+01  0.142911D+02  0.633060D+01 -0.965372D+01
      3   0.166582D+02 -0.147734D+01  0.116721D+02 -0.392035D+01 -0.918872D+01
      4  -0.190023D+02  0.889601D+01 -0.923133D+01  0.115709D+02  0.568582D+01
      5  -0.291721D+02 -0.238238D+01 -0.581184D+01  0.344771D+01 -0.886150D+01
      6  -0.803837D+01  0.595240D+01 -0.710233D-01  0.426091D+01 -0.958678D+01
                 6             7             8             9            10 
      1   0.752330D+01 -0.197801D+02  0.612702D+01 -0.951141D+00  0.105858D+02
      2  -0.998041D+01  0.113589D+02 -0.817091D+01 -0.358975D+01 -0.718962D+01
      3   0.245711D+01  0.842118D+01  0.204389D+01  0.454089D+01 -0.339622D+01
      4  -0.864998D+01 -0.442173D+01 -0.626087D+01 -0.432860D+01 -0.168440D+01
      5  -0.498997D+01 -0.678142D+01 -0.381015D+01  0.367393D+01  0.118477D+02
      6  -0.975678D+01 -0.216187D+00 -0.780115D+01  0.116410D+00  0.917360D+01
                11            12            13            14            15 
      1   0.221309D+01  0.145439D+02  0.210491D+00 -0.180947D+02 -0.276288D+01
      2  -0.112405D+02 -0.564594D+01 -0.120026D+02  0.415706D+01  0.106657D+02
      3   0.902736D+01 -0.889798D+01  0.117921D+02  0.139376D+02 -0.790286D+01
      4  -0.238583D+02  0.762211D+01 -0.295109D+02 -0.259392D+02  0.197513D+02
      5   0.215658D+00 -0.962693D+01  0.202067D+01  0.222885D+02  0.394307D+01
      6   0.528148D+01 -0.100028D+01  0.110286D+02  0.127443D+02 -0.307545D+01
                16            17            18            19            20 
      1   0.984581D+01 -0.445627D+01 -0.587535D+01  0.836678D+00  0.319043D+01
      2  -0.310100D+01  0.994701D+01  0.230114D+01 -0.445967D+01  0.187008D+01
      3  -0.674481D+01 -0.549074D+01  0.357421D+01  0.362299D+01 -0.506051D+01
      4   0.469019D+01  0.145416D+02  0.446734D+00  0.776622D+01  0.142325D+02
      5  -0.863359D+01  0.216253D+01 -0.289043D+01 -0.423642D+01 -0.275846D+01
      6  -0.153970D+01 -0.420933D+01 -0.326857D+01 -0.827589D+01 -0.678708D+01
                21            22            23            24            25 
      1  -0.714703D+01 -0.137814D+01  0.160189D+02 -0.838988D+00 -0.175099D+01
      2   0.465018D+01  0.408656D+01 -0.195787D+02  0.264899D+01  0.199695D+01
      3   0.249685D+01 -0.270842D+01  0.355985D+01 -0.181001D+01 -0.245959D+00
      4  -0.934351D+01  0.912135D+01  0.908012D+01 -0.522646D+01 -0.496382D+01
      5   0.484571D+01 -0.115741D+01 -0.705251D+01  0.279960D+01  0.515437D+01
      6   0.247018D+01 -0.688030D+01 -0.554451D+00  0.535823D+01  0.100013D+01
                26            27            28            29            30 
      1  -0.180000D+01  0.110935D+02 -0.103912D+02  0.769273D-01  0.468448D+01
      2   0.136469D+01  0.496685D+01  0.270271D+01 -0.657521D-01 -0.602390D+01
      3   0.435308D+00 -0.160604D+02  0.768852D+01 -0.111752D-01  0.133942D+01
      4  -0.218762D+01  0.180557D+01  0.417467D-01 -0.565797D+01 -0.359712D+00
      5   0.473389D+00  0.616105D+01  0.298134D+01 -0.214145D+00 -0.256676D+01
      6   0.355136D+01  0.617907D+01 -0.205027D+00 -0.348997D+01  0.301504D-03
                31            32            33            34            35 
      1  -0.270487D-01  0.217806D+01 -0.372582D+00  0.835276D+01 -0.554307D+00
      2   0.320089D-01 -0.916591D+01  0.411659D+00 -0.913747D+01  0.579484D+00
      3  -0.496015D-02  0.698785D+01 -0.390771D-01  0.784711D+00 -0.251762D-01
      4  -0.703821D+01 -0.868928D-02 -0.615985D+01 -0.581441D+00 -0.882395D+01
      5  -0.204133D+00 -0.366740D+01  0.106343D-01  0.482045D+01 -0.177998D-01
      6  -0.339020D+01  0.245742D+00 -0.211563D+01 -0.148688D-01  0.370923D+01
                36            37            38            39            40 
      1  -0.455512D+00  0.158552D+00 -0.131684D+01 -0.628864D+01  0.281161D+01
      2  -0.558318D+00 -0.410914D+01 -0.374150D+01  0.373152D+01 -0.551863D+01
      3   0.101383D+01  0.395059D+01  0.505834D+01  0.255712D+01  0.270701D+01
      4   0.354825D-02 -0.697654D+01  0.140725D+02  0.956055D+01  0.867269D+01
      5   0.967300D+00 -0.373068D+01  0.230403D+01  0.461203D+01  0.701283D+00
      6  -0.314418D-01  0.782755D+01 -0.717445D+01 -0.244405D+01 -0.720290D+01
                41            42            43            44            45 
      1   0.151048D+02  0.650161D+00 -0.124776D+01  0.166126D+01  0.109460D+02
      2  -0.183379D+02 -0.229711D+01  0.152872D+01 -0.118174D+01  0.511195D+01
      3   0.323309D+01  0.164694D+01 -0.280958D+00 -0.479514D+00 -0.160580D+02
      4  -0.116013D+02 -0.577058D+01  0.501848D+01 -0.253436D+01 -0.205206D+01
      5  -0.715397D+01 -0.273477D+01  0.508517D+01 -0.509461D+00  0.587259D+01
      6   0.151627D+01  0.558209D+01 -0.106965D+01  0.359982D+01 -0.648470D+01
                46            47            48            49            50 
      1   0.104005D+02 -0.536377D+01  0.140049D+02 -0.384433D+01 -0.154017D+02
      2  -0.611929D+01  0.136188D+02 -0.548975D+01  0.148765D+02  0.585037D+00
      3  -0.428122D+01 -0.825502D+01 -0.851511D+01 -0.110322D+02  0.148167D+02
      4  -0.131198D+01 -0.219550D+02 -0.761178D+01 -0.276291D+02  0.290530D+02
      5   0.113712D+02  0.475920D+00 -0.975526D+01 -0.107393D+01  0.217368D+02
      6  -0.896481D+01  0.506430D+01  0.129291D+01  0.108807D+02 -0.144055D+02
                51            52            53            54            55 
      1   0.384911D+01  0.963862D+01  0.528128D+01 -0.592526D+01 -0.433530D+02
      2  -0.121411D+02 -0.316583D+01 -0.110613D+02  0.236263D+01  0.265061D+02
      3   0.829202D+01 -0.647279D+01  0.577999D+01  0.356263D+01  0.168469D+02
      4   0.194199D+02 -0.460141D+01  0.140490D+02 -0.123363D+00  0.228937D+02
      5  -0.369915D+01 -0.865311D+01 -0.202108D+01 -0.271434D+01 -0.287573D+02
      6  -0.293757D+01  0.172571D+01 -0.415861D+01  0.339931D+01  0.969019D+01
                56            57            58            59            60 
      1   0.112323D+02 -0.254031D+02  0.597776D+01  0.176505D+02 -0.717072D+01
      2  -0.115979D+02  0.138528D+02 -0.879658D+01 -0.826913D+01  0.101086D+02
      3   0.365672D+00  0.115503D+02  0.281882D+01 -0.938141D+01 -0.293789D+01
      4   0.683909D+01  0.105495D+02  0.989193D+01 -0.767670D+01 -0.831174D+01
      5   0.348788D+01 -0.556456D+01 -0.242048D+01 -0.844410D+01  0.481544D+01
      6   0.585629D+01 -0.128970D+00  0.442410D+01  0.951587D+01 -0.997415D+01
                61            62            63            64            65 
      1  -0.195700D+02 -0.581628D+01 -0.532435D+00  0.106461D+02 -0.689258D+01
      2   0.112660D+02  0.819947D+01 -0.399110D+01 -0.101906D+02  0.600519D+01
      3   0.830401D+01 -0.238319D+01  0.452353D+01 -0.455443D+00  0.887393D+00
      4   0.546484D+01 -0.585433D+01  0.419337D+01 -0.209968D+02 -0.611233D+01
      5  -0.657022D+01  0.376705D+01  0.365507D+01  0.115762D+02 -0.527972D+01
      6   0.145599D+00 -0.799051D+01 -0.251558D+00 -0.373207D+01 -0.467300D+01
                66            67            68            69            70 
      1   0.658695D+01 -0.112154D+02 -0.876807D+01 -0.376004D+01  0.378238D+01
      2  -0.658657D+01  0.788838D+01  0.142126D+01  0.175156D+01 -0.296269D+01
      3  -0.375657D-03  0.332705D+01  0.734680D+01  0.200848D+01 -0.819685D+00
      4  -0.886078D+01  0.720415D-01 -0.462365D+01  0.688344D+01 -0.455118D+01
      5   0.801617D+01 -0.605420D+01  0.219790D+01 -0.159893D+01  0.469820D+01
      6  -0.144708D+01 -0.250149D+01 -0.203383D+01  0.318839D+01 -0.127956D+01
                71            72            73            74            75 
      1  -0.136495D+01  0.910043D+01  0.131314D+02  0.544442D+01  0.751562D+01
      2   0.299575D+01  0.819265D+01 -0.125181D+02 -0.489337D+01 -0.742677D+01
      3  -0.163080D+01 -0.172931D+02 -0.613346D+00 -0.551050D+00 -0.888456D-01
      4   0.237881D+01 -0.486969D+01  0.196786D+02 -0.728546D+01  0.854233D+01
      5  -0.205973D+01 -0.871320D+01  0.121926D+02  0.465861D+01  0.814664D+01
      6   0.374790D+01  0.818127D+00  0.291298D+01 -0.494999D+01  0.123295D+01
                76            77            78            79            80 
      1   0.103038D+02 -0.910319D+01  0.403655D+01  0.425533D+01  0.137221D+01
      2  -0.730843D+01  0.158707D+01 -0.202730D+01 -0.349535D+01 -0.303679D+01
      3  -0.299540D+01  0.751612D+01 -0.200924D+01 -0.759982D+00  0.166458D+01
      4  -0.140956D+01  0.537999D+01  0.625697D+01  0.431883D+01  0.199456D+01
      5   0.553079D+01  0.181428D+01  0.139023D+01  0.486647D+01  0.202064D+01
      6  -0.281190D+01  0.226420D+01  0.306900D+01  0.123798D+01  0.361118D+01
                81            82            83            84            85 
      1   0.954014D+01 -0.802270D+01 -0.373790D+01  0.108655D+02 -0.659615D+01
      2   0.776818D+01  0.111203D+02  0.366331D+01 -0.347132D+01  0.101577D+02
      3  -0.173083D+02 -0.309759D+01  0.745917D-01 -0.739422D+01 -0.356156D+01
      4   0.481939D+01 -0.688225D+01  0.222044D+01  0.585037D+01  0.199117D+01
      5  -0.875209D+01  0.957022D+01 -0.125011D+01 -0.260052D+01 -0.155848D+01
      6  -0.452273D+00  0.572907D+01 -0.465978D+01  0.497066D+01 -0.349713D+01
                86            87            88            89            90 
      1  -0.183561D+02  0.893796D+01  0.715534D+01  0.451935D+01  0.335240D+01
      2   0.189158D+02 -0.170624D+02 -0.931112D-01 -0.842046D+01  0.558910D+01
      3  -0.559743D+00  0.812443D+01 -0.706223D+01  0.390111D+01 -0.894150D+01
      4   0.513006D+01 -0.355392D+01  0.644668D+01 -0.272155D+01  0.299120D+01
      5  -0.751403D+01  0.192365D+01 -0.141636D+01  0.490059D+00 -0.188516D+01
      6  -0.130627D+02  0.475490D+01  0.386747D+01  0.196406D+01  0.733942D+01
                91            92            93            94            95 
      1  -0.210462D+01  0.198155D+01 -0.703066D+01  0.758992D+01  0.182864D+02
      2  -0.163477D+00 -0.361216D+01  0.437139D+01 -0.135598D+02 -0.246536D+02
      3   0.226810D+01  0.163062D+01  0.265927D+01  0.596987D+01  0.636724D+01
      4  -0.693266D+01 -0.350094D+01 -0.128570D+02 -0.468933D+01 -0.122798D+02
      5  -0.591084D+01 -0.161275D+01 -0.346065D+01 -0.116530D+01  0.753178D+01
      6  -0.130704D+02  0.372408D+01 -0.886829D+01  0.451393D+01  0.312821D+02
                96            97            98            99           100 
      1  -0.165140D+02 -0.986625D+01 -0.215019D+02  0.308477D+01  0.723734D+02
      2   0.314146D+02  0.812947D+01  0.350621D+02 -0.763090D+01 -0.391025D+02
      3  -0.149006D+02  0.173678D+01 -0.135602D+02  0.454613D+01 -0.332709D+02
      4   0.597968D+01 -0.142463D+02  0.928151D+01 -0.122190D+02 -0.333350D+02
      5  -0.520005D+00 -0.486511D+01 -0.364930D+01 -0.245472D+00  0.331452D+02
      6  -0.102156D+02 -0.120818D+02 -0.136794D+02  0.200048D+01 -0.101145D+02
               101           102           103           104           105 
      1  -0.104552D+02  0.202226D+02  0.211823D+01  0.556317D+01  0.228314D+01
      2   0.312465D+01 -0.133060D+02 -0.475977D+01 -0.172184D+01 -0.344934D+01
      3   0.733057D+01 -0.691661D+01  0.264154D+01 -0.384133D+01  0.116620D+01
      4   0.137816D+02 -0.960883D+01  0.105097D+02 -0.548821D+01  0.418962D+01
      5  -0.540405D+01  0.186802D+02  0.723333D+00  0.519318D+01 -0.685493D+00
      6   0.336332D+01 -0.658957D+01  0.289929D+01 -0.318649D+01  0.369672D+01
               106           107           108           109           110 
      1   0.154710D+02 -0.979102D+00  0.114021D+02 -0.238576D+01 -0.945845D+01
      2  -0.124397D+02 -0.431700D+00 -0.930931D+01  0.260020D+01  0.863852D+01
      3  -0.303135D+01  0.141080D+01 -0.209275D+01 -0.214439D+00  0.819923D+00
      4  -0.883646D+01  0.460049D+01 -0.741321D+01 -0.573239D+00 -0.101621D+01
      5   0.216280D+02 -0.447933D+01  0.136891D+02  0.330790D+01 -0.638202D+00
      6  -0.749861D+01  0.458323D+01 -0.489054D+01 -0.519775D+01 -0.590684D+01
               111           112           113           114           115 
      1   0.899039D+01 -0.552385D+01 -0.192560D+02  0.998005D+01  0.579907D+01
      2  -0.495482D+01  0.353304D+01  0.243716D+02 -0.933569D+01 -0.264187D+01
      3  -0.403558D+01  0.199081D+01 -0.511560D+01 -0.644361D+00 -0.315720D+01
      4  -0.203474D+01  0.475487D+01 -0.147408D+02  0.711068D+01 -0.467497D+01
      5  -0.828240D+00 -0.211421D+01  0.729772D+01 -0.890988D+01  0.334738D+01
      6   0.526310D+01 -0.454965D+00 -0.183494D+02  0.144969D+02  0.330032D+00
               116           117           118           119           120 
      1   0.772676D+01 -0.977372D+01  0.151325D+02 -0.100234D+02 -0.545647D+01
      2  -0.589622D+01  0.473472D+01 -0.412354D+00 -0.300210D+01  0.122929D+01
      3  -0.183053D+01  0.503899D+01 -0.147201D+02  0.130256D+02  0.422718D+01
      4   0.717816D+01 -0.548458D+01 -0.253636D+02  0.240942D+02  0.816117D+01
      5  -0.669234D+01  0.808865D+01 -0.113116D+02  0.759916D+01  0.897926D+01
      6   0.131573D+02 -0.133510D+02  0.749830D+01 -0.599660D+01 -0.478500D+01
               121           122           123           124           125 
      1  -0.911691D+01  0.603147D+00 -0.116803D+01 -0.391382D+01 -0.142423D+01
      2  -0.904882D+01  0.242744D+02  0.682001D+01  0.109370D+01  0.367299D+01
      3   0.181657D+02 -0.248776D+02 -0.565198D+01  0.282012D+01 -0.224876D+01
      4   0.346429D+02 -0.471851D+02 -0.160525D+02  0.937389D+01 -0.125750D+02
      5   0.106057D+02 -0.159844D+02 -0.103746D+02  0.121449D+02 -0.112163D+02
      6  -0.109129D+02  0.184795D+02  0.115871D+02 -0.839019D+01  0.124975D+02
               126           127           128           129           130 
      1   0.103719D+01  0.227073D+02  0.754372D+01 -0.101980D+02  0.158019D+02
      2   0.148290D+01 -0.162951D+02 -0.693884D+01  0.849268D+01 -0.135868D+02
      3  -0.252009D+01 -0.641218D+01 -0.604881D+00  0.170532D+01 -0.221513D+01
      4  -0.120515D+02  0.177343D+01  0.693399D+01 -0.361471D-01  0.700005D+01
      5  -0.918143D+01 -0.154748D+02 -0.397041D+01  0.128560D+02 -0.929837D+01
      6   0.874397D+01  0.110334D+01 -0.181954D+01 -0.206786D+01 -0.280093D+01
               131           132           133           134           135 
      1   0.898121D+01 -0.559398D+01 -0.988178D+01 -0.158493D+01  0.661243D+01
      2  -0.820086D+01  0.874282D+01  0.951401D+01  0.493592D+01 -0.108595D+02
      3  -0.780351D+00 -0.314883D+01  0.367772D+00 -0.335099D+01  0.424710D+01
      4   0.834289D+01 -0.732269D+01  0.176061D+01 -0.601386D+01  0.257852D+01
      5  -0.103059D+02  0.117607D+02  0.137229D+02  0.557678D+01 -0.151110D+02
      6  -0.160210D+01  0.382262D+00 -0.148925D+01  0.251312D+01  0.131809D+01
               136           137           138           139           140 
      1   0.183551D+02  0.115115D+02 -0.616811D+01  0.115410D+02  0.373099D+01
      2  -0.225703D+01  0.189042D+01  0.169281D+01  0.700163D+01  0.197571D+02
      3  -0.160980D+02 -0.134019D+02  0.447530D+01 -0.185426D+02 -0.234881D+02
      4   0.271642D+02  0.245986D+02 -0.855289D+01  0.354148D+02  0.454392D+02
      5  -0.124766D+02 -0.804959D+01  0.965201D+01 -0.112726D+02 -0.159544D+02
      6  -0.772599D+01 -0.610255D+01  0.487503D+01 -0.108887D+02 -0.170535D+02
               141           142           143           144           145 
      1   0.215040D-01 -0.471417D+01  0.520815D+00  0.208904D+01  0.215510D+02
      2  -0.548610D+01  0.178924D+01 -0.264967D+01  0.430096D+00 -0.152447D+02
      3   0.546460D+01  0.292493D+01  0.212885D+01 -0.251913D+01 -0.630634D+01
      4  -0.159961D+02 -0.969075D+01 -0.123624D+02  0.120422D+02 -0.279039D+01
      5   0.104751D+02  0.130177D+02  0.112133D+02 -0.957365D+01 -0.149326D+02
      6   0.109330D+02  0.838150D+01  0.116563D+02 -0.835365D+01 -0.647353D+00
               146           147           148           149           150 
      1  -0.750869D+01 -0.993614D+01 -0.157640D+02  0.923896D+01  0.537624D+01
      2   0.665690D+01  0.808507D+01  0.132834D+02 -0.831491D+01 -0.843568D+01
      3   0.851790D+00  0.185107D+01  0.248062D+01 -0.924052D+00  0.305944D+01
      4   0.728279D+01  0.502580D+00  0.799616D+01 -0.975951D+01 -0.795116D+01
      5   0.409312D+01  0.124069D+02  0.938212D+01 -0.108078D+02 -0.122723D+02
      6  -0.188070D+01  0.154509D+01 -0.309357D+01  0.227416D+01  0.830354D+00
               151           152           153           154           155 
      1  -0.994132D+01  0.148259D+01  0.635907D+01  0.753321D+02  0.865346D+01
      2   0.941993D+01 -0.480948D+01 -0.105762D+02 -0.416920D+02 -0.259502D+01
      3   0.521389D+00  0.332689D+01  0.421710D+01 -0.336401D+02 -0.605844D+01
      4  -0.118585D+01 -0.622757D+01 -0.332561D+01  0.294292D+02  0.121142D+02
      5   0.135127D+02 -0.604758D+01 -0.151102D+02  0.337346D+02  0.433747D+01
      6   0.100654D+01  0.271589D+01 -0.649782D+00  0.894541D+01  0.287682D+01
               156           157           158           159           160 
      1   0.209017D+02 -0.416035D+01  0.569610D+01 -0.280757D+01  0.162581D+02
      2  -0.139329D+02  0.553179D+01 -0.222326D+01  0.368046D+01 -0.131542D+02
      3  -0.696886D+01 -0.137145D+01 -0.347284D+01 -0.872888D+00 -0.310396D+01
      4   0.833073D+01  0.973488D+01  0.418788D+01  0.407601D+01  0.782148D+01
      5   0.189871D+02 -0.180559D+01  0.517182D+01  0.361787D-01  0.221440D+02
      6   0.594299D+01  0.267701D+01  0.271931D+01  0.341528D+01  0.676005D+01
               161           162           163           164           165 
      1   0.686214D+00  0.120188D+02 -0.171450D+01  0.865300D+01  0.873198D+01
      2   0.599110D+00 -0.992414D+01  0.206217D+01 -0.763100D+01 -0.473006D+01
      3  -0.128532D+01 -0.209464D+01 -0.347671D+00 -0.102200D+01 -0.400191D+01
      4   0.424120D+01  0.651055D+01  0.918233D+00 -0.112168D+01  0.176751D+01
      5   0.373691D+01  0.139151D+02  0.363879D+01  0.577415D+00 -0.640890D+00
      6   0.410492D+01  0.430994D+01  0.480307D+01 -0.536428D+01 -0.460609D+01
               166           167           168           169           170 
      1   0.525143D+01 -0.185481D+02 -0.970835D+01  0.588768D+01 -0.733461D+01
      2  -0.304819D+01  0.235506D+02  0.890172D+01 -0.280648D+01  0.537704D+01
      3  -0.220323D+01 -0.500256D+01  0.806625D+00 -0.308120D+01  0.195757D+01
      4   0.504353D+01  0.164392D+02  0.784107D+01  0.462917D+01  0.753818D+01
      5   0.229418D+01  0.795878D+01  0.955618D+01  0.364152D+01  0.709512D+01
      6   0.149356D-01  0.182730D+02  0.143019D+02  0.773111D-01  0.128562D+02
               171           172           173           174           175 
      1  -0.925627D+01  0.130609D+02 -0.631436D+01  0.497174D+00 -0.119906D+02
      2   0.423895D+01 -0.487774D+01  0.234503D+01 -0.852882D+00  0.653820D+01
      3   0.501732D+01 -0.818319D+01  0.396934D+01  0.355709D+00  0.545237D+01
      4   0.608285D+01 -0.112372D+02  0.116732D+02 -0.248541D+01  0.954530D+01
      5   0.863581D+01  0.367497D+01 -0.302446D+01  0.331031D+01 -0.861364D+01
      6   0.129666D+02 -0.316377D+01  0.380691D+01 -0.136057D+01  0.450908D+01
               176           177           178           179           180 
      1   0.456059D+01 -0.255577D+01 -0.613836D+01  0.111865D+01 -0.103556D+01
      2   0.804825D+00  0.394364D+01  0.297205D+01  0.817181D+00 -0.830005D+00
      3  -0.536541D+01 -0.138787D+01  0.316631D+01 -0.193583D+01  0.186556D+01
      4  -0.181699D+02  0.204343D+01 -0.196670D+01 -0.227124D+01 -0.386893D+01
      5   0.318082D+01 -0.581190D+01  0.349905D+00 -0.310998D+01  0.838776D+00
      6  -0.686028D+01  0.218248D+01 -0.123613D+01  0.961138D+00 -0.172737D+01
               181           182           183           184           185 
      1  -0.337881D+01 -0.195140D+00  0.357826D+01  0.210863D+00 -0.120802D+01
      2   0.919234D+00 -0.561231D+00  0.169101D+01 -0.122712D+00 -0.203105D+01
      3   0.245957D+01  0.756371D+00 -0.526927D+01 -0.881507D-01  0.323907D+01
      4  -0.277433D+01  0.591719D+00 -0.439437D+00  0.323445D+01 -0.220356D+00
      5  -0.992104D+00 -0.388084D+00  0.901820D+00 -0.505856D+00  0.301644D+01
      6   0.234384D+00  0.615651D+00 -0.553434D-01  0.168875D+01 -0.398658D+00
               186           187           188           189           190 
      1  -0.439422D-01  0.247682D+01  0.206782D+01 -0.177032D+02 -0.429622D+01
      2   0.755098D+00 -0.648051D+01  0.173030D+01 -0.198513D+02  0.591090D+01
      3  -0.711156D+00  0.400369D+01 -0.379812D+01  0.375545D+02 -0.161468D+01
      4   0.338063D+01  0.142882D+01  0.454826D+01 -0.369681D+01 -0.482571D+01
      5  -0.647926D+00  0.875905D+01 -0.247817D+01  0.241481D+02  0.306489D+01
      6   0.560255D+01  0.263934D+00  0.354499D+01  0.857453D+00  0.235098D+00
               191           192           193           194           195 
      1   0.683181D+01 -0.185439D+01  0.701668D+01 -0.209458D+02  0.473297D+01
      2  -0.870067D+01  0.119139D+01 -0.672499D+01  0.323234D+02 -0.398523D+01
      3   0.186886D+01  0.662993D+00 -0.291685D+00 -0.113776D+02 -0.747736D+00
      4   0.761861D+00  0.178686D+01  0.616045D+01  0.210252D+01 -0.648369D+00
      5  -0.490356D+00 -0.673107D+00 -0.292050D+01  0.190715D+01  0.108761D+01
      6   0.654767D+01 -0.315913D+01  0.140646D+01 -0.122829D+02  0.662880D+01
               196           197           198           199           200 
      1   0.162271D+01  0.747062D+00 -0.452104D+01 -0.586347D+00  0.146293D+01
      2  -0.135111D+01  0.299715D+01  0.247559D+01 -0.255848D+01 -0.105158D+01
      3  -0.271594D+00 -0.374422D+01  0.204545D+01  0.314483D+01 -0.411354D+00
      4   0.322193D+01  0.358653D+01 -0.164703D+01  0.425892D+00 -0.528334D+00
      5  -0.890040D+00 -0.114440D+00  0.593822D+00 -0.186700D+01 -0.276420D-01
      6  -0.213430D+01  0.285957D+01 -0.196821D+01 -0.643535D+00  0.208955D+01
               201           202           203           204           205 
      1  -0.340086D+01 -0.121118D+01 -0.393157D+01  0.220045D+00 -0.322457D+01
      2   0.928653D+00  0.110543D+01  0.149724D+01 -0.454073D+01  0.295571D+01
      3   0.247220D+01  0.105751D+00  0.243433D+01  0.432069D+01  0.268852D+00
      4  -0.108913D+01 -0.179841D+01 -0.312957D+01 -0.527651D-01 -0.412117D+01
      5   0.411045D+01  0.849631D+00  0.346005D+00 -0.218306D+01  0.417311D+01
      6  -0.176180D+01  0.174535D+01 -0.825030D+00  0.243522D+01  0.956444D+00
               206           207           208           209           210 
      1   0.498002D+01 -0.215180D+02 -0.444808D+01 -0.743709D+01 -0.218633D+01
      2  -0.136980D+00 -0.149609D+02  0.615634D+01  0.974232D+01  0.150020D+01
      3  -0.484304D+01  0.364789D+02 -0.170826D+01 -0.230523D+01  0.686127D+00
      4  -0.298410D+01 -0.459859D+00  0.563234D+01  0.121096D+01 -0.166171D+01
      5   0.335387D+01 -0.149873D+02  0.322772D+01  0.742337D+00 -0.568022D+00
      6   0.784584D+01 -0.192672D+02 -0.170268D-01  0.702375D+01  0.346275D+01
               211           212           213           214           215 
      1  -0.716857D+01 -0.204030D+02 -0.464928D+01  0.132989D+01 -0.461014D+00
      2   0.731117D+01  0.317188D+02  0.392538D+01 -0.121892D+01 -0.330424D+01
      3  -0.142593D+00 -0.113158D+02  0.723896D+00 -0.110970D+00  0.376526D+01
      4   0.650574D+01 -0.104471D+00 -0.190416D+00 -0.319585D+01  0.361587D+01
      5   0.294320D+01  0.228654D+01 -0.772947D+00 -0.792929D+00  0.267199D+00
      6   0.180309D+01  0.117513D+02  0.649424D+01  0.228934D+01  0.274076D+01
               216           217           218           219           220 
      1  -0.435411D+01 -0.658361D+00 -0.164352D+01 -0.331476D+01  0.911938D+00
      2   0.232164D+01 -0.249920D+01  0.126207D+01  0.102018D+01 -0.770243D+00
      3   0.203246D+01  0.315757D+01  0.381446D+00  0.229458D+01 -0.141695D+00
      4   0.194522D+01 -0.603320D+00 -0.241921D+00  0.128724D+01 -0.171134D+01
      5   0.680305D+00 -0.185571D+01  0.222977D+00  0.426978D+01 -0.663794D+00
      6   0.191545D+01  0.903003D+00  0.208811D+01  0.169284D+01  0.177299D+01
               221           222           223           224           225 
      1  -0.363132D+01 -0.979504D-01 -0.309045D+01 -0.513551D+01 -0.214785D+02
      2   0.121079D+01  0.447745D+01  0.259128D+01  0.270273D+00 -0.149687D+02
      3   0.242053D+01 -0.437950D+01  0.499173D+00  0.486523D+01  0.364473D+02
      4   0.343741D+01  0.102567D+00  0.425690D+01 -0.294050D+01  0.729605D+00
      5   0.402686D+00  0.207705D+01  0.397852D+01 -0.319871D+01 -0.140974D+02
      6   0.660711D+00  0.229019D+01 -0.782057D+00  0.806029D+01  0.199514D+02
               226           227           228           229           230 
      1   0.147914D+02  0.689864D+01  0.821876D+00  0.123655D+02  0.525048D+01
      2  -0.623014D+01 -0.307536D+01 -0.122902D+01 -0.706567D+01 -0.299723D+00
      3  -0.856122D+01 -0.382328D+01  0.407142D+00 -0.529981D+01 -0.495076D+01
      4   0.112763D+02  0.115285D+02  0.248506D+01  0.897450D+01  0.170633D+02
      5   0.430355D+01  0.313749D+01  0.360519D+01  0.874845D+01  0.295478D+01
      6   0.333166D+01  0.380839D+01  0.130009D+01  0.427178D+01  0.637539D+01
               231           232           233           234           235 
      1   0.267675D+01 -0.599471D+01 -0.105796D+01 -0.703897D+00 -0.311027D+01
      2  -0.405207D+01  0.275421D+01 -0.737849D+00 -0.116071D+01  0.681929D+00
      3   0.137533D+01  0.324050D+01  0.179581D+01  0.186461D+01  0.242834D+01
      4   0.164936D+01  0.225977D+01 -0.234593D+01  0.386150D+01  0.310394D+01
      5   0.574622D+01  0.534201D+00  0.312440D+01  0.909904D+00 -0.954471D+00
      6   0.187521D+01  0.125180D+01  0.774376D+00  0.169448D+01 -0.939900D-01
               236           237           238           239           240 
      1   0.322361D+00  0.362692D+01  0.147464D+00 -0.120750D+01  0.175597D+00
      2   0.400291D+00  0.161436D+01 -0.269857D+00 -0.205698D+01 -0.111488D+01
      3  -0.722652D+00 -0.524128D+01  0.122393D+00  0.326448D+01  0.939283D+00
      4   0.481377D+00  0.499411D+00  0.310799D+01  0.219792D-01  0.331311D+01
      5   0.582890D+00  0.938341D+00  0.745932D+00  0.297644D+01  0.844924D+00
      6   0.614988D+00  0.254857D+00  0.167887D+01  0.170169D+00  0.556045D+01
               241           242           243           244           245 
      1   0.225807D+01 -0.177195D+01 -0.173817D+02 -0.189969D+01 -0.133999D+01
      2  -0.642100D+01 -0.184758D+01 -0.201574D+02 -0.443879D-01  0.277551D+01
      3   0.416293D+01  0.361953D+01  0.375391D+02  0.194407D+01 -0.143552D+01
      4  -0.161354D+01  0.461936D+01  0.358049D+01  0.669625D+01 -0.307943D+01
      5   0.883850D+01  0.224525D+01  0.240579D+02 -0.516812D+01  0.228097D+01
      6  -0.492594D+00  0.345747D+01 -0.189352D+01  0.135953D+02  0.164256D+01
               246           247           248           249           250 
      1  -0.511334D+01 -0.702640D+01  0.197219D+02  0.171962D+02 -0.757514D+01
      2   0.180067D+01  0.127967D+02 -0.264467D+02 -0.319698D+02  0.524413D+01
      3   0.331267D+01 -0.577030D+01  0.672477D+01  0.147736D+02  0.233101D+01
      4   0.134726D+02 -0.358095D+01  0.106474D+02  0.324911D+01  0.152730D+02
      5  -0.305683D+01  0.186573D+01  0.597577D+01  0.199597D+00 -0.418115D+01
      6   0.854595D+01  0.245836D+01 -0.318633D+02 -0.106049D+02  0.116516D+02
               251           252           253           254           255 
      1   0.225795D+02  0.414131D+01 -0.690346D+01  0.338628D+01  0.990233D+01
      2  -0.360638D+02 -0.868270D+01  0.985949D+01 -0.341905D+01 -0.215258D+01
      3   0.134843D+02  0.454139D+01 -0.295603D+01  0.327697D-01 -0.774975D+01
      4   0.607339D+01  0.116877D+02  0.781591D+01  0.137729D+01 -0.657853D+01
      5   0.322284D+01 -0.332516D+00  0.939128D+01  0.303282D+00 -0.291682D+01
      6  -0.143379D+02 -0.198598D+01 -0.649564D+01 -0.381502D+01 -0.461858D+01
               256           257           258           259           260 
      1   0.621782D+01 -0.191799D+02 -0.965194D+01  0.635826D+01 -0.504023D+01
      2  -0.987835D+01  0.198976D+02  0.174341D+02  0.873511D+00  0.862739D+01
      3   0.366053D+01 -0.717663D+00 -0.778219D+01 -0.723177D+01 -0.358715D+01
      4   0.743577D+00 -0.358478D+01 -0.210838D+01 -0.684851D+01 -0.183955D+01
      5   0.664155D+00 -0.700142D+01 -0.158038D+01 -0.162270D+01 -0.336876D+00
      6  -0.268211D+01  0.137021D+02  0.503323D+01 -0.371246D+01  0.213976D+01
               261           262           263           264           265 
      1   0.308478D+01  0.180328D+02 -0.282917D+01 -0.595993D+01 -0.591868D+00
      2   0.584580D+01 -0.159954D+02  0.598507D+01  0.830217D+01  0.250650D+01
      3  -0.893058D+01 -0.203738D+01 -0.315590D+01 -0.234223D+01 -0.191463D+01
      4  -0.288382D+01  0.157597D+02  0.646275D+01 -0.777885D+01  0.127824D+01
      5  -0.221378D+01 -0.183219D+02 -0.306831D+01  0.114201D+02  0.229553D+01
      6  -0.724926D+01 -0.750904D+01 -0.361888D+01  0.669018D+01 -0.278800D+00
               266           267           268           269           270 
      1   0.416554D+01 -0.546268D+00 -0.330372D+01 -0.570278D+00  0.147338D+01
      2  -0.281245D+01 -0.499101D+00  0.678491D+01  0.166017D+01 -0.746868D+01
      3  -0.135308D+01  0.104537D+01 -0.348120D+01 -0.108990D+01  0.599529D+01
      4   0.407030D+00  0.273155D+00 -0.300606D+01 -0.305063D+00  0.339236D+01
      5  -0.352688D+00 -0.131626D+01  0.829819D+01  0.225989D+00 -0.756029D+01
      6   0.138722D+01 -0.747499D-01  0.352482D+01  0.136139D+01 -0.514028D+01
               271           272           273           274           275 
      1  -0.163932D+00  0.658253D+01 -0.774388D+01  0.191625D+01 -0.196099D+01
      2  -0.458869D+01 -0.650520D+01 -0.202269D+01 -0.196577D+01 -0.637779D+00
      3   0.475263D+01 -0.773229D-01  0.976657D+01  0.495268D-01  0.259877D+01
      4  -0.369199D+01 -0.770300D+00 -0.354851D+01 -0.361624D-01 -0.207867D+01
      5   0.188680D+01  0.235513D+00  0.365517D+01  0.121016D-01  0.218224D+01
      6  -0.254148D+01  0.572963D+01 -0.894734D+01  0.243397D+01 -0.261799D+01
               276           277           278           279           280 
      1   0.170236D+01 -0.238363D+01  0.669450D+01 -0.159789D+02  0.122549D+02
      2  -0.748035D+00 -0.121352D+01 -0.235066D+01 -0.129454D+02 -0.250783D+01
      3  -0.954329D+00  0.359715D+01 -0.434384D+01  0.289244D+02 -0.974710D+01
      4   0.130672D+01 -0.338446D+01 -0.950925D+00 -0.321672D+01  0.256286D+02
      5  -0.940409D+00  0.394309D+01  0.370573D+00 -0.141735D+01  0.766929D+01
      6   0.536768D+01 -0.158756D+01  0.805528D+01 -0.211819D+02  0.982172D+01
               281           282           283           284           285 
      1  -0.227669D+01  0.463224D+01 -0.343727D+01 -0.173001D+01 -0.776054D+00
      2   0.101450D+02 -0.122542D+01  0.755026D+01  0.596621D+01  0.867323D+00
      3  -0.786835D+01 -0.340682D+01 -0.411299D+01 -0.423620D+01 -0.912685D-01
      4   0.122412D+02  0.974944D+01  0.649538D+01  0.886216D+01  0.192586D+01
      5   0.175893D+01  0.636780D+01  0.709213D+00  0.178506D+01  0.788948D+00
      6   0.307327D+01  0.867413D+01  0.122332D+01  0.159614D+01  0.355153D+01
               286           287           288           289           290 
      1   0.505743D+01 -0.831463D+00  0.620340D+00 -0.338344D+01 -0.956680D+00
      2  -0.212185D+01  0.417433D+01  0.623538D+00  0.856900D+01  0.603724D+01
      3  -0.293559D+01 -0.334287D+01 -0.124388D+01 -0.518556D+01 -0.508056D+01
      4   0.158227D+02  0.625026D+01  0.106806D+02  0.822950D+01  0.158633D+02
      5   0.795621D+01  0.326858D+01  0.765552D+01 -0.153708D+01 -0.348818D+01
      6   0.110758D+02  0.817348D+01  0.133480D+02 -0.471452D+01 -0.451099D+01
               291           292           293           294           295 
      1   0.106406D+01 -0.511437D+01 -0.379031D+02  0.136029D+02  0.450297D+01
      2  -0.241162D+01  0.118973D+02  0.670725D+02 -0.215672D+02 -0.672717D+01
      3   0.134756D+01 -0.678297D+01 -0.291694D+02  0.796433D+01  0.222420D+01
      4  -0.501517D+01  0.124134D+02  0.203845D+02 -0.779183D+01 -0.584741D+01
      5   0.377632D+01 -0.187461D+01 -0.494889D+01  0.309044D+01  0.410471D+01
      6   0.361861D+01 -0.642899D+01 -0.306757D+02  0.184878D+02  0.772559D+01
               296           297           298           299           300 
      1   0.210505D+02 -0.135521D+02 -0.378270D+01  0.760969D+00  0.867778D+00
      2  -0.305689D+02  0.165112D+02  0.849218D+01 -0.475619D+01 -0.185987D+01
      3   0.951845D+01 -0.295905D+01 -0.470949D+01  0.399522D+01  0.992095D+00
      4  -0.114319D+02  0.846239D+01 -0.648452D+01  0.150870D+02  0.455955D+01
      5   0.542883D+01 -0.450106D+01 -0.111312D+01  0.317210D+01  0.350567D+01
      6   0.276045D+02 -0.214948D+02  0.433201D+01 -0.347763D+01 -0.295002D+01
               301           302           303           304           305 
      1   0.459666D+01 -0.398203D+02 -0.142699D+02  0.401947D+01 -0.221582D+02
      2  -0.102963D+02  0.694845D+02  0.222871D+02 -0.582066D+01  0.317718D+02
      3   0.569965D+01 -0.296642D+02 -0.801726D+01  0.180119D+01 -0.961368D+01
      4   0.112055D+02 -0.168481D+02 -0.641105D+01  0.491620D+01 -0.932823D+01
      5   0.147677D+01 -0.379261D+01 -0.242372D+01  0.356692D+01 -0.436011D+01
      6  -0.532727D+01  0.312952D+02  0.187479D+02 -0.665652D+01  0.281322D+02
               306           307           308           309           310 
      1  -0.142356D+02  0.102618D+02  0.276512D+01  0.379152D+01  0.342925D+01
      2   0.172011D+02 -0.105363D+01 -0.108542D+02 -0.391432D+00 -0.776135D+01
      3  -0.296542D+01 -0.920813D+01  0.808905D+01 -0.340009D+01  0.433210D+01
      4  -0.709689D+01 -0.253868D+02  0.123974D+02 -0.988577D+01  0.672692D+01
      5  -0.354045D+01  0.711834D+01 -0.186637D+01  0.594396D+01 -0.898215D+00
      6   0.216584D+02 -0.994523D+01  0.352449D+01 -0.878207D+01  0.161601D+01
               311           312           313           314           315 
      1  -0.280505D+01  0.772161D+00  0.369868D+01  0.120807D+01 -0.325622D+00
      2   0.758095D+01 -0.101317D+01 -0.917412D+00 -0.467202D+01  0.156095D+01
      3  -0.477589D+01  0.241005D+00 -0.278127D+01  0.346395D+01 -0.123533D+01
      4  -0.929506D+01  0.228066D+01 -0.158005D+02  0.671378D+01 -0.106376D+02
      5   0.182320D+01 -0.894368D+00  0.732303D+01 -0.323060D+01  0.705718D+01
      6  -0.187874D+01  0.397247D+01 -0.110378D+02  0.880346D+01 -0.136729D+02
               316           317           318           319           320 
      1   0.167105D+02  0.281847D+01 -0.521479D+01  0.139924D+00  0.395558D+01
      2  -0.149075D+02 -0.599629D+01  0.760476D+01 -0.207328D+01 -0.237328D+01
      3  -0.180298D+01  0.317782D+01 -0.238997D+01  0.193335D+01 -0.158230D+01
      4  -0.168729D+02  0.677361D+01  0.839859D+01  0.185661D+01 -0.106707D+01
      5  -0.179204D+02  0.369163D+01  0.111723D+02 -0.152660D+01 -0.480087D+00
      6   0.813682D+01 -0.417793D+01 -0.719861D+01 -0.602378D+00 -0.117393D+01
               321           322           323           324           325 
      1   0.800340D+00 -0.299021D+01  0.667642D+00  0.115332D+01 -0.235863D+00
      2   0.138285D+00  0.642472D+01 -0.191190D+01 -0.715402D+01 -0.451913D+01
      3  -0.938625D+00 -0.343451D+01  0.124426D+01  0.600070D+01  0.475499D+01
      4  -0.104250D+00  0.343096D+01 -0.558142D+00 -0.378593D+01  0.348861D+01
      5   0.815255D+00  0.812964D+01 -0.532983D+00 -0.733747D+01  0.200439D+01
      6   0.189400D+00 -0.383530D+01  0.154951D+01  0.548405D+01  0.282283D+01
               326           327           328           329           330 
      1  -0.669589D+01 -0.748521D+01 -0.197944D+01 -0.138892D+01 -0.124873D+01
      2   0.671372D+01 -0.231941D+01  0.212616D+01 -0.121001D+01  0.729933D+00
      3  -0.178340D-01  0.980463D+01 -0.146717D+00  0.259893D+01  0.518801D+00
      4  -0.246396D+00  0.385299D+01  0.744036D-01  0.213307D+01  0.124281D+01
      5   0.351682D-01  0.409804D+01  0.111406D+00  0.229387D+01  0.995169D+00
      6   0.572156D+01  0.900907D+01  0.242108D+01  0.215808D+01  0.492636D+01
               331           332           333 
      1  -0.238624D+01 -0.664760D+01 -0.156756D+02
      2  -0.141034D+01  0.247043D+01 -0.132243D+02
      3   0.379658D+01  0.417717D+01  0.289000D+02
      4   0.340357D+01 -0.693784D+00  0.334731D+01
      5   0.400308D+01 -0.181804D+00 -0.461314D+00
      6   0.177920D+01  0.798664D+01  0.212137D+02
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Thu Jul  8 21:37:12 2021, MaxMem= 10737418240 cpu:          119130.4 elap:            7454.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -14.80827 -14.80825 -14.80804 -14.80802 -14.80802
 Alpha  occ. eigenvalues --  -14.80793 -10.63081 -10.63058 -10.63005 -10.63000
 Alpha  occ. eigenvalues --  -10.62971 -10.62966  -3.67190  -2.44572  -2.44568
 Alpha  occ. eigenvalues --   -2.44148  -1.37288  -1.36197  -1.36162  -1.33727
 Alpha  occ. eigenvalues --   -1.33698  -1.33650  -1.15713  -1.15525  -1.15513
 Alpha  occ. eigenvalues --   -1.03946  -1.03778  -1.03177  -0.96620  -0.96397
 Alpha  occ. eigenvalues --   -0.96208  -0.95195  -0.94493  -0.94145  -0.93543
 Alpha  occ. eigenvalues --   -0.93419  -0.93068  -0.87281  -0.87183  -0.86435
 Alpha  occ. eigenvalues --   -0.86165  -0.85865  -0.85756  -0.83753  -0.82817
 Alpha  occ. eigenvalues --   -0.82814  -0.79136  -0.79105  -0.78210  -0.77736
 Alpha  occ. eigenvalues --   -0.77256  -0.76703  -0.75081  -0.74189  -0.74177
 Alpha  occ. eigenvalues --   -0.71039  -0.71033  -0.70773
 Alpha virt. eigenvalues --   -0.47647  -0.47641  -0.41107  -0.38984  -0.38211
 Alpha virt. eigenvalues --   -0.38029  -0.34930  -0.34898  -0.34504  -0.33209
 Alpha virt. eigenvalues --   -0.32603  -0.31931  -0.31650  -0.30698  -0.29599
 Alpha virt. eigenvalues --   -0.29433  -0.28961  -0.28656  -0.27914  -0.27692
 Alpha virt. eigenvalues --   -0.27559  -0.26448  -0.26207  -0.25752  -0.25186
 Alpha virt. eigenvalues --   -0.25172  -0.24573  -0.24023  -0.23839  -0.23393
 Alpha virt. eigenvalues --   -0.23016  -0.22456  -0.22119  -0.22051  -0.21477
 Alpha virt. eigenvalues --   -0.21286  -0.21266  -0.20662  -0.20556  -0.20339
 Alpha virt. eigenvalues --   -0.20304  -0.20214  -0.19254  -0.19017  -0.18710
 Alpha virt. eigenvalues --   -0.18567  -0.18197  -0.18110  -0.17891  -0.17761
 Alpha virt. eigenvalues --   -0.16908  -0.16844  -0.16638  -0.16400  -0.16357
 Alpha virt. eigenvalues --   -0.15990  -0.15505  -0.15314  -0.15302  -0.14847
 Alpha virt. eigenvalues --   -0.14823  -0.14437  -0.14393  -0.13843  -0.13564
 Alpha virt. eigenvalues --   -0.13384  -0.13148  -0.12940  -0.12817  -0.12717
 Alpha virt. eigenvalues --   -0.12510  -0.12277  -0.11919  -0.11751  -0.11311
 Alpha virt. eigenvalues --   -0.11070  -0.10961  -0.10772  -0.10473  -0.10326
 Alpha virt. eigenvalues --   -0.10182  -0.09334  -0.09253  -0.09014  -0.08931
 Alpha virt. eigenvalues --   -0.08547  -0.08206  -0.08047  -0.07893  -0.07763
 Alpha virt. eigenvalues --   -0.07000  -0.06896  -0.06698  -0.06204  -0.06141
 Alpha virt. eigenvalues --   -0.05808  -0.05037  -0.04560  -0.04350  -0.04196
 Alpha virt. eigenvalues --   -0.03841  -0.03711  -0.03241  -0.02856  -0.02626
 Alpha virt. eigenvalues --   -0.01955  -0.01522  -0.00721  -0.00497  -0.00109
 Alpha virt. eigenvalues --    0.00116   0.00556   0.00881   0.01568   0.01738
 Alpha virt. eigenvalues --    0.02209   0.02338   0.02679   0.03130   0.03221
 Alpha virt. eigenvalues --    0.03663   0.03776   0.04008   0.04012   0.04155
 Alpha virt. eigenvalues --    0.04435   0.05118   0.05321   0.05645   0.06058
 Alpha virt. eigenvalues --    0.06219   0.06483   0.06806   0.07546   0.08553
 Alpha virt. eigenvalues --    0.08803   0.09159   0.09830   0.10149   0.10220
 Alpha virt. eigenvalues --    0.10515   0.10850   0.10913   0.11334   0.11460
 Alpha virt. eigenvalues --    0.11639   0.12328   0.12622   0.13246   0.13784
 Alpha virt. eigenvalues --    0.13897   0.14036   0.14242   0.14681   0.14923
 Alpha virt. eigenvalues --    0.15453   0.16004   0.16099   0.16805   0.17212
 Alpha virt. eigenvalues --    0.17289   0.18325   0.18542   0.19043   0.19679
 Alpha virt. eigenvalues --    0.19985   0.20407   0.20889   0.21735   0.22291
 Alpha virt. eigenvalues --    0.23005   0.23332   0.23746   0.24389   0.24568
 Alpha virt. eigenvalues --    0.24860   0.25277   0.25451   0.25936   0.26648
 Alpha virt. eigenvalues --    0.26806   0.27115   0.27122   0.27917   0.28454
 Alpha virt. eigenvalues --    0.28489   0.28823   0.28852   0.29257   0.30205
 Alpha virt. eigenvalues --    0.30375   0.30703   0.30975   0.31322   0.31895
 Alpha virt. eigenvalues --    0.32298   0.32396   0.32566   0.33243   0.33820
 Alpha virt. eigenvalues --    0.34644   0.34854   0.35990   0.35996   0.36129
 Alpha virt. eigenvalues --    0.36392   0.36734   0.37360   0.37804   0.38039
 Alpha virt. eigenvalues --    0.38403   0.39332   0.39368   0.39595   0.39731
 Alpha virt. eigenvalues --    0.40572   0.41314   0.43038   0.43679   0.43943
 Alpha virt. eigenvalues --    0.44680   0.44810   0.45192   0.46166   0.46420
 Alpha virt. eigenvalues --    0.47129   0.47925   0.48286   0.48392   0.49219
 Alpha virt. eigenvalues --    0.49410   0.49944   0.50061   0.50231   0.51299
 Alpha virt. eigenvalues --    0.51470   0.52434   0.52436   0.53400   0.54111
 Alpha virt. eigenvalues --    0.54788   0.55549   0.55958   0.56197   0.57079
 Alpha virt. eigenvalues --    0.58039   0.58639   0.58650   0.59076   0.59778
 Alpha virt. eigenvalues --    0.60784   0.62382   0.62963   0.64272   0.64858
 Alpha virt. eigenvalues --    0.65638   0.65801   0.66461   0.67534   0.67740
 Alpha virt. eigenvalues --    0.68522   0.68823   0.69788   0.70077   0.71119
 Alpha virt. eigenvalues --    0.71682   0.73085   0.73976   0.75236   0.75798
 Alpha virt. eigenvalues --    0.77931   0.78486   0.78779   0.79222   0.80951
 Alpha virt. eigenvalues --    0.83043   0.83299   0.83743   0.84388   0.84695
 Alpha virt. eigenvalues --    0.86212   0.87180   0.89120   0.89238   0.91916
 Alpha virt. eigenvalues --    0.92488   0.92858   0.94222   0.94744   0.96575
 Alpha virt. eigenvalues --    0.98746   0.98846   0.99861   1.03571   1.04419
 Alpha virt. eigenvalues --    1.07319   1.07380   1.09246   1.09318   1.10122
 Alpha virt. eigenvalues --    1.10925   1.11738   1.12870   1.15314   1.17116
 Alpha virt. eigenvalues --    1.18287   1.19906   1.19953   1.20185   1.21203
 Alpha virt. eigenvalues --    1.22224   1.24478   1.24694   1.25871   1.25948
 Alpha virt. eigenvalues --    1.26368   1.27685   1.28008   1.28748   1.29911
 Alpha virt. eigenvalues --    1.32352   1.33712   1.34187   1.35880   1.36411
 Alpha virt. eigenvalues --    1.36477   1.37545   1.37590   1.38506   1.38687
 Alpha virt. eigenvalues --    1.39949   1.39995   1.40218   1.40413   1.42109
 Alpha virt. eigenvalues --    1.42165   1.44034   1.44091   1.46074   1.46504
 Alpha virt. eigenvalues --    1.47351   1.48949   1.50045   1.50817   1.51013
 Alpha virt. eigenvalues --    1.51986   1.52567   1.53041   1.54110   1.54608
 Alpha virt. eigenvalues --    1.54943   1.55765   1.56616   1.57011   1.57923
 Alpha virt. eigenvalues --    1.58817   1.59166   1.59588   1.61119   1.61297
 Alpha virt. eigenvalues --    1.62009   1.63721   1.63982   1.64920   1.66356
 Alpha virt. eigenvalues --    1.66900   1.67340   1.68118   1.69088   1.70136
 Alpha virt. eigenvalues --    1.70343   1.71664   1.71969   1.73806   1.74891
 Alpha virt. eigenvalues --    1.76007   1.76058   1.77040   1.77820   1.78431
 Alpha virt. eigenvalues --    1.80394   1.81011   1.82511   1.83507   1.83871
 Alpha virt. eigenvalues --    1.84222   1.84614   1.85363   1.86707   1.87962
 Alpha virt. eigenvalues --    1.88548   1.88580   1.89234   1.91237   1.93569
 Alpha virt. eigenvalues --    1.94430   1.95097   1.96454   1.97616   1.98047
 Alpha virt. eigenvalues --    1.99457   2.00848   2.02746   2.02775   2.03224
 Alpha virt. eigenvalues --    2.04039   2.06215   2.06783   2.07123   2.08210
 Alpha virt. eigenvalues --    2.09123   2.10868   2.11148   2.12698   2.13724
 Alpha virt. eigenvalues --    2.13932   2.15290   2.15493   2.15665   2.16535
 Alpha virt. eigenvalues --    2.18365   2.18860   2.19271   2.19781   2.20307
 Alpha virt. eigenvalues --    2.20764   2.21418   2.22194   2.23080   2.23446
 Alpha virt. eigenvalues --    2.24880   2.25890   2.27442   2.28019   2.28938
 Alpha virt. eigenvalues --    2.29296   2.29476   2.30169   2.30643   2.31258
 Alpha virt. eigenvalues --    2.31802   2.32226   2.33674   2.34157   2.34513
 Alpha virt. eigenvalues --    2.36276   2.37573   2.38744   2.41354   2.42637
 Alpha virt. eigenvalues --    2.45333   2.47155   2.48368   2.50418   2.53652
 Alpha virt. eigenvalues --    2.53874   2.55691   2.56358   2.60822   2.63324
 Alpha virt. eigenvalues --    2.64670   2.67785   2.68989   2.69266   2.70809
 Alpha virt. eigenvalues --    2.73190   2.73830   2.81759   2.82147   2.83769
 Alpha virt. eigenvalues --    2.84352   2.87392   2.90828   2.96217   2.96635
 Alpha virt. eigenvalues --    2.97392   2.99033   2.99872   3.00505   3.06924
 Alpha virt. eigenvalues --    3.09411   3.14526   3.26533   3.36590   3.79886
 Alpha virt. eigenvalues --    5.67792   5.93484  45.05186
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C    5.642173   0.202003   0.305803  -1.792694  -0.080636  -0.044323
     2  C    0.202003   5.777342   1.318553  -2.116554   0.219515   0.003710
     3  N    0.305803   1.318553  10.821599  -8.258440   0.811888   0.218692
     4  Rh  -1.792694  -2.116554  -8.258440  75.400155  -8.291291  -2.126485
     5  N   -0.080636   0.219515   0.811888  -8.291291  10.837122   1.321578
     6  C   -0.044323   0.003710   0.218692  -2.126485   1.321578   5.780799
     7  C   -0.082623  -0.044060  -0.078946  -1.805249   0.309072   0.202285
     8  N   -0.036425   0.023975   0.411049  -8.797657   0.802425   0.168323
     9  N    1.352774   0.166336   0.797686  -8.775468   0.415647   0.024387
    10  N   -0.048803  -0.020487   0.388519  -8.408522   0.396957   0.185921
    11  C    0.012733  -0.045669   0.095514  -1.468190  -0.078695  -0.006701
    12  H   -0.006237   0.004074  -0.016964   0.569699   0.000168  -0.020552
    13  H    0.012227  -0.007410   0.032125   0.323210   0.021062  -0.055079
    14  H    0.003176   0.003039   0.012801   0.793198  -0.873753  -0.208083
    15  H    0.005127  -0.014813  -0.040762   0.370726  -0.133882  -0.694266
    16  H   -0.066818  -0.207591  -0.872301   0.790227   0.012704   0.003065
    17  H   -0.031256  -0.693015  -0.134261   0.370529  -0.040683  -0.014836
    18  H   -0.158084  -0.020272   0.000468   0.568539  -0.017075   0.004136
    19  H   -0.654528  -0.054402   0.021612   0.320600   0.032481  -0.007500
    20  H   -0.186516   0.039176  -0.053598  -0.163696   0.075127   0.010256
    21  H    0.009962  -0.009152   0.000152   0.197440  -0.095286  -0.015745
    22  H    0.047121  -0.145321   0.324123  -0.049717  -0.017510   0.005586
    23  H   -0.031357  -0.016409  -0.008100   0.187159   0.031528   0.011967
    24  H    0.010441   0.005604  -0.017513  -0.049486   0.323167  -0.145409
    25  H    0.033730   0.012030   0.031395   0.188356  -0.009285  -0.016498
    26  H    0.008694   0.010202   0.074836  -0.164116  -0.053637   0.039209
    27  H   -0.003606  -0.015701  -0.094981   0.196793   0.000090  -0.008781
    28  C   -0.001554  -0.007410  -0.079136  -1.473116   0.095578  -0.045509
    29  N    0.209985   0.183651   0.395487  -8.405596   0.390785  -0.019639
    30  H   -0.004883   0.007232   0.003945   0.014924  -0.057371   0.014288
    31  H   -0.008120  -0.005305   0.005251  -0.046874   0.005001   0.027627
    32  H   -0.012751  -0.000895  -0.009182  -0.024410  -0.021314  -0.001951
    33  H    0.014500  -0.003551   0.005761   0.597387   0.007390   0.001639
    34  H   -0.014710   0.001607   0.007334   0.595471   0.005758  -0.003591
    35  H    0.011177  -0.002020  -0.021467  -0.021578  -0.009213  -0.000876
    36  H   -0.001762   0.014668  -0.057279   0.014586   0.003975   0.007270
    37  H    0.006129   0.027451   0.004877  -0.046489   0.005289  -0.005338
               7          8          9         10         11         12
     1  C   -0.082623  -0.036425   1.352774  -0.048803   0.012733  -0.006237
     2  C   -0.044060   0.023975   0.166336  -0.020487  -0.045669   0.004074
     3  N   -0.078946   0.411049   0.797686   0.388519   0.095514  -0.016964
     4  Rh  -1.805249  -8.797657  -8.775468  -8.408522  -1.468190   0.569699
     5  N    0.309072   0.802425   0.415647   0.396957  -0.078695   0.000168
     6  C    0.202285   0.168323   0.024387   0.185921  -0.006701  -0.020552
     7  C    5.643433   1.355873  -0.036214   0.211677  -0.001444  -0.158316
     8  N    1.355873  10.699218   0.462028   1.170613   0.230699  -0.697578
     9  N   -0.036214   0.462028  10.688012   0.496404   0.127646  -0.002406
    10  N    0.211677   1.170613   0.496404  10.250847   1.055109   0.027379
    11  C   -0.001444   0.230699   0.127646   1.055109   5.534522  -0.009221
    12  H   -0.158316  -0.697578  -0.002406   0.027379  -0.009221   2.560065
    13  H   -0.654129  -0.162087  -0.012695  -0.048575   0.008773  -0.627227
    14  H   -0.067596  -0.021434   0.023269  -0.022072   0.008857  -0.058207
    15  H   -0.030269  -0.040706  -0.033458   0.003785  -0.000526  -0.191818
    16  H    0.003134   0.023227  -0.020928   0.000811  -0.005113   0.000499
    17  H    0.005174  -0.033247  -0.040645  -0.029398  -0.001166   0.000211
    18  H   -0.006255  -0.002394  -0.696456   0.020792   0.008266   0.000001
    19  H    0.012269  -0.012728  -0.160612  -0.032599  -0.006295  -0.000909
    20  H    0.008679   0.028505   0.331728  -0.004591   0.009683   0.000172
    21  H   -0.003569   0.000492   0.058796   0.013859   0.019669  -0.000923
    22  H    0.010524  -0.047191  -0.035997   0.021656   0.006307  -0.000523
    23  H    0.033729   0.002223  -0.005975   0.000574  -0.010075   0.007999
    24  H    0.046919  -0.036254  -0.047130   0.051563   0.000679   0.013286
    25  H   -0.031524  -0.005793   0.002266  -0.013228   0.009847   0.003987
    26  H   -0.186657   0.331682   0.028523   0.029237   0.034180  -0.016371
    27  H    0.009829   0.059457   0.000503   0.011484  -0.010229   0.036501
    28  C    0.012757   0.128679   0.230234   0.021565   0.018398   0.008387
    29  N   -0.048284   0.500972   1.167779   0.925158   0.019439   0.020816
    30  H   -0.001656  -0.023163   0.033228   0.218415  -0.002038   0.002433
    31  H    0.006178   0.028184  -0.056230   0.404950  -0.094287   0.003018
    32  H    0.011111   0.027621  -0.056564   0.065199  -0.533696  -0.006917
    33  H   -0.014696  -0.051334   0.042734  -0.680831  -0.334722  -0.000410
    34  H    0.014600   0.042632  -0.051063  -0.040818   0.131527   0.001467
    35  H   -0.012817  -0.056446   0.026908   0.083491  -0.076949  -0.000153
    36  H   -0.004856   0.033434  -0.023349   0.009536   0.010335  -0.000262
    37  H   -0.008072  -0.056284   0.028181  -0.050444   0.017015   0.006026
              13         14         15         16         17         18
     1  C    0.012227   0.003176   0.005127  -0.066818  -0.031256  -0.158084
     2  C   -0.007410   0.003039  -0.014813  -0.207591  -0.693015  -0.020272
     3  N    0.032125   0.012801  -0.040762  -0.872301  -0.134261   0.000468
     4  Rh   0.323210   0.793198   0.370726   0.790227   0.370529   0.568539
     5  N    0.021062  -0.873753  -0.133882   0.012704  -0.040683  -0.017075
     6  C   -0.055079  -0.208083  -0.694266   0.003065  -0.014836   0.004136
     7  C   -0.654129  -0.067596  -0.030269   0.003134   0.005174  -0.006255
     8  N   -0.162087  -0.021434  -0.040706   0.023227  -0.033247  -0.002394
     9  N   -0.012695   0.023269  -0.033458  -0.020928  -0.040645  -0.696456
    10  N   -0.048575  -0.022072   0.003785   0.000811  -0.029398   0.020792
    11  C    0.008773   0.008857  -0.000526  -0.005113  -0.001166   0.008266
    12  H   -0.627227  -0.058207  -0.191818   0.000499   0.000211   0.000001
    13  H    2.791612  -0.179170   0.221336  -0.000103  -0.000994  -0.000907
    14  H   -0.179170   2.628069  -0.624763   0.002910  -0.001082   0.000511
    15  H    0.221336  -0.624763   2.867676  -0.001080  -0.001005   0.000209
    16  H   -0.000103   0.002910  -0.001080   2.627263  -0.624275  -0.058379
    17  H   -0.000994  -0.001082  -0.001005  -0.624275   2.866577  -0.191693
    18  H   -0.000907   0.000511   0.000209  -0.058379  -0.191693   2.559524
    19  H    0.005839  -0.000114  -0.001000  -0.178891   0.221150  -0.627403
    20  H   -0.000098  -0.000536  -0.000890   0.013330  -0.013201  -0.016561
    21  H    0.000566   0.003378   0.000065   0.002522  -0.001412   0.036446
    22  H    0.011871  -0.001190  -0.003519  -0.025165   0.059420   0.013299
    23  H   -0.014402   0.005599  -0.006463   0.061486  -0.104787   0.003997
    24  H   -0.023590  -0.025056   0.059535  -0.001211  -0.003507  -0.000526
    25  H   -0.003401   0.061510  -0.104798   0.005607  -0.006471   0.008007
    26  H    0.056672   0.013346  -0.013244  -0.000531  -0.000891   0.000173
    27  H   -0.087376   0.002514  -0.001343   0.003377   0.000088  -0.000925
    28  C   -0.006421  -0.005066  -0.001318   0.008867  -0.000523  -0.009043
    29  N   -0.032598   0.000856  -0.029557  -0.022055   0.004388   0.027504
    30  H   -0.007493  -0.004493   0.011244   0.000533  -0.000699  -0.000263
    31  H   -0.003948   0.004312  -0.008813  -0.000698  -0.001961   0.006015
    32  H   -0.000143  -0.002158   0.001464  -0.000544  -0.000121  -0.000149
    33  H    0.000010  -0.000237   0.008684  -0.000067  -0.000563   0.001447
    34  H    0.000092  -0.000067  -0.000580  -0.000233   0.008633  -0.000415
    35  H   -0.001399  -0.000542  -0.000126  -0.002143   0.001473  -0.006828
    36  H   -0.000220   0.000534  -0.000704  -0.004436   0.010933   0.002440
    37  H   -0.003421  -0.000709  -0.001966   0.004302  -0.008715   0.002999
              19         20         21         22         23         24
     1  C   -0.654528  -0.186516   0.009962   0.047121  -0.031357   0.010441
     2  C   -0.054402   0.039176  -0.009152  -0.145321  -0.016409   0.005604
     3  N    0.021612  -0.053598   0.000152   0.324123  -0.008100  -0.017513
     4  Rh   0.320600  -0.163696   0.197440  -0.049717   0.187159  -0.049486
     5  N    0.032481   0.075127  -0.095286  -0.017510   0.031528   0.323167
     6  C   -0.007500   0.010256  -0.015745   0.005586   0.011967  -0.145409
     7  C    0.012269   0.008679  -0.003569   0.010524   0.033729   0.046919
     8  N   -0.012728   0.028505   0.000492  -0.047191   0.002223  -0.036254
     9  N   -0.160612   0.331728   0.058796  -0.035997  -0.005975  -0.047130
    10  N   -0.032599  -0.004591   0.013859   0.021656   0.000574   0.051563
    11  C   -0.006295   0.009683   0.019669   0.006307  -0.010075   0.000679
    12  H   -0.000909   0.000172  -0.000923  -0.000523   0.007999   0.013286
    13  H    0.005839  -0.000098   0.000566   0.011871  -0.014402  -0.023590
    14  H   -0.000114  -0.000536   0.003378  -0.001190   0.005599  -0.025056
    15  H   -0.001000  -0.000890   0.000065  -0.003519  -0.006463   0.059535
    16  H   -0.178891   0.013330   0.002522  -0.025165   0.061486  -0.001211
    17  H    0.221150  -0.013201  -0.001412   0.059420  -0.104787  -0.003507
    18  H   -0.627403  -0.016561   0.036446   0.013299   0.003997  -0.000526
    19  H    2.791556   0.056671  -0.087378  -0.023764  -0.003348   0.011939
    20  H    0.056671   0.902784  -0.133312  -0.001803   0.003087   0.001222
    21  H   -0.087378  -0.133312   1.000445   0.003393  -0.000861   0.002090
    22  H   -0.023764  -0.001803   0.003393   0.892443  -0.135024   0.008720
    23  H   -0.003348   0.003087  -0.000861  -0.135024   1.012632  -0.004925
    24  H    0.011939   0.001222   0.002090   0.008720  -0.004925   0.893300
    25  H   -0.014499  -0.002497   0.006322  -0.004914   0.003148  -0.135090
    26  H   -0.000098  -0.000828   0.000464   0.001211  -0.002502  -0.001789
    27  H    0.000579   0.000469   0.000209   0.002070   0.006349   0.003398
    28  C    0.008675   0.034128  -0.010052   0.000718   0.009869   0.006317
    29  N   -0.048442   0.029080   0.011302   0.051342  -0.013133   0.021643
    30  H   -0.000228   0.001910  -0.002747   0.000042   0.000700   0.002328
    31  H   -0.003435  -0.000519   0.008464   0.000651   0.000590  -0.001227
    32  H   -0.001395  -0.003249  -0.004446   0.001034   0.000326   0.000632
    33  H    0.000098  -0.001079   0.005956  -0.000038  -0.000727  -0.000978
    34  H    0.000009   0.002028   0.002860  -0.000974   0.001647  -0.000039
    35  H   -0.000188  -0.000755  -0.002569   0.000621  -0.001798   0.001042
    36  H   -0.007494   0.004595  -0.001513   0.002303   0.001248   0.000043
    37  H   -0.003933  -0.001882   0.002349  -0.001225   0.003016   0.000648
              25         26         27         28         29         30
     1  C    0.033730   0.008694  -0.003606  -0.001554   0.209985  -0.004883
     2  C    0.012030   0.010202  -0.015701  -0.007410   0.183651   0.007232
     3  N    0.031395   0.074836  -0.094981  -0.079136   0.395487   0.003945
     4  Rh   0.188356  -0.164116   0.196793  -1.473116  -8.405596   0.014924
     5  N   -0.009285  -0.053637   0.000090   0.095578   0.390785  -0.057371
     6  C   -0.016498   0.039209  -0.008781  -0.045509  -0.019639   0.014288
     7  C   -0.031524  -0.186657   0.009829   0.012757  -0.048284  -0.001656
     8  N   -0.005793   0.331682   0.059457   0.128679   0.500972  -0.023163
     9  N    0.002266   0.028523   0.000503   0.230234   1.167779   0.033228
    10  N   -0.013228   0.029237   0.011484   0.021565   0.925158   0.218415
    11  C    0.009847   0.034180  -0.010229   0.018398   0.019439  -0.002038
    12  H    0.003987  -0.016371   0.036501   0.008387   0.020816   0.002433
    13  H   -0.003401   0.056672  -0.087376  -0.006421  -0.032598  -0.007493
    14  H    0.061510   0.013346   0.002514  -0.005066   0.000856  -0.004493
    15  H   -0.104798  -0.013244  -0.001343  -0.001318  -0.029557   0.011244
    16  H    0.005607  -0.000531   0.003377   0.008867  -0.022055   0.000533
    17  H   -0.006471  -0.000891   0.000088  -0.000523   0.004388  -0.000699
    18  H    0.008007   0.000173  -0.000925  -0.009043   0.027504  -0.000263
    19  H   -0.014499  -0.000098   0.000579   0.008675  -0.048442  -0.000228
    20  H   -0.002497  -0.000828   0.000469   0.034128   0.029080   0.001910
    21  H    0.006322   0.000464   0.000209  -0.010052   0.011302  -0.002747
    22  H   -0.004914   0.001211   0.002070   0.000718   0.051342   0.000042
    23  H    0.003148  -0.002502   0.006349   0.009869  -0.013133   0.000700
    24  H   -0.135090  -0.001789   0.003398   0.006317   0.021643   0.002328
    25  H    1.013124   0.003088  -0.000852  -0.010055   0.000609   0.001251
    26  H    0.003088   0.903027  -0.133400   0.009747  -0.004325   0.004705
    27  H   -0.000852  -0.133400   0.999890   0.019724   0.013296  -0.001536
    28  C   -0.010055   0.009747   0.019724   5.536806   1.056975   0.010418
    29  N    0.000609  -0.004325   0.013296   1.056975  10.246484   0.009273
    30  H    0.001251   0.004705  -0.001536   0.010418   0.009273   1.004917
    31  H    0.003019  -0.001915   0.002371   0.016840  -0.049984  -0.135965
    32  H   -0.001808  -0.000629  -0.002593  -0.077582   0.084757  -0.087886
    33  H    0.001658   0.002011   0.002855   0.131156  -0.041375   0.005341
    34  H   -0.000724  -0.001140   0.005972  -0.334800  -0.679092   0.014481
    35  H    0.000310  -0.003249  -0.004446  -0.534889   0.064626  -0.003183
    36  H    0.000703   0.001927  -0.002763  -0.002171   0.218410  -0.000982
    37  H    0.000592  -0.000538   0.008518  -0.094581   0.405508   0.004886
              31         32         33         34         35         36
     1  C   -0.008120  -0.012751   0.014500  -0.014710   0.011177  -0.001762
     2  C   -0.005305  -0.000895  -0.003551   0.001607  -0.002020   0.014668
     3  N    0.005251  -0.009182   0.005761   0.007334  -0.021467  -0.057279
     4  Rh  -0.046874  -0.024410   0.597387   0.595471  -0.021578   0.014586
     5  N    0.005001  -0.021314   0.007390   0.005758  -0.009213   0.003975
     6  C    0.027627  -0.001951   0.001639  -0.003591  -0.000876   0.007270
     7  C    0.006178   0.011111  -0.014696   0.014600  -0.012817  -0.004856
     8  N    0.028184   0.027621  -0.051334   0.042632  -0.056446   0.033434
     9  N   -0.056230  -0.056564   0.042734  -0.051063   0.026908  -0.023349
    10  N    0.404950   0.065199  -0.680831  -0.040818   0.083491   0.009536
    11  C   -0.094287  -0.533696  -0.334722   0.131527  -0.076949   0.010335
    12  H    0.003018  -0.006917  -0.000410   0.001467  -0.000153  -0.000262
    13  H   -0.003948  -0.000143   0.000010   0.000092  -0.001399  -0.000220
    14  H    0.004312  -0.002158  -0.000237  -0.000067  -0.000542   0.000534
    15  H   -0.008813   0.001464   0.008684  -0.000580  -0.000126  -0.000704
    16  H   -0.000698  -0.000544  -0.000067  -0.000233  -0.002143  -0.004436
    17  H   -0.001961  -0.000121  -0.000563   0.008633   0.001473   0.010933
    18  H    0.006015  -0.000149   0.001447  -0.000415  -0.006828   0.002440
    19  H   -0.003435  -0.001395   0.000098   0.000009  -0.000188  -0.007494
    20  H   -0.000519  -0.003249  -0.001079   0.002028  -0.000755   0.004595
    21  H    0.008464  -0.004446   0.005956   0.002860  -0.002569  -0.001513
    22  H    0.000651   0.001034  -0.000038  -0.000974   0.000621   0.002303
    23  H    0.000590   0.000326  -0.000727   0.001647  -0.001798   0.001248
    24  H   -0.001227   0.000632  -0.000978  -0.000039   0.001042   0.000043
    25  H    0.003019  -0.001808   0.001658  -0.000724   0.000310   0.000703
    26  H   -0.001915  -0.000629   0.002011  -0.001140  -0.003249   0.001927
    27  H    0.002371  -0.002593   0.002855   0.005972  -0.004446  -0.002763
    28  C    0.016840  -0.077582   0.131156  -0.334800  -0.534889  -0.002171
    29  N   -0.049984   0.084757  -0.041375  -0.679092   0.064626   0.218410
    30  H   -0.135965  -0.087886   0.005341   0.014481  -0.003183  -0.000982
    31  H    0.843093   0.043805  -0.016071   0.006176  -0.026560   0.004887
    32  H    0.043805   2.784945  -0.600604  -0.174156   0.210858  -0.003145
    33  H   -0.016071  -0.600604   2.572941  -0.042293  -0.173984   0.014428
    34  H    0.006176  -0.174156  -0.042293   2.572079  -0.600575   0.005380
    35  H   -0.026560   0.210858  -0.173984  -0.600575   2.785157  -0.087785
    36  H    0.004887  -0.003145   0.014428   0.005380  -0.087785   1.005023
    37  H   -0.004989  -0.026574   0.006189  -0.016260   0.043874  -0.135964
              37
     1  C    0.006129
     2  C    0.027451
     3  N    0.004877
     4  Rh  -0.046489
     5  N    0.005289
     6  C   -0.005338
     7  C   -0.008072
     8  N   -0.056284
     9  N    0.028181
    10  N   -0.050444
    11  C    0.017015
    12  H    0.006026
    13  H   -0.003421
    14  H   -0.000709
    15  H   -0.001966
    16  H    0.004302
    17  H   -0.008715
    18  H    0.002999
    19  H   -0.003933
    20  H   -0.001882
    21  H    0.002349
    22  H   -0.001225
    23  H    0.003016
    24  H    0.000648
    25  H    0.000592
    26  H   -0.000538
    27  H    0.008518
    28  C   -0.094581
    29  N    0.405508
    30  H    0.004886
    31  H   -0.004989
    32  H   -0.026574
    33  H    0.006189
    34  H   -0.016260
    35  H    0.043874
    36  H   -0.135964
    37  H    0.842632
 Mulliken charges:
               1
     1  C    1.379929
     2  C    1.409866
     3  N    0.653461
     4  Rh  -2.213371
     5  N    0.655325
     6  C    1.410425
     7  C    1.379989
     8  N    0.549410
     9  N    0.550123
    10  N    0.334868
    11  C    1.325819
    12  H   -0.451192
    13  H   -0.552507
    14  H   -0.471549
    15  H   -0.568183
    16  H   -0.471300
    17  H   -0.568171
    18  H   -0.451147
    19  H   -0.552296
    20  H    0.032983
    21  H   -0.018235
    22  H    0.029419
    23  H   -0.028986
    24  H    0.029214
    25  H   -0.029120
    26  H    0.032926
    27  H   -0.017803
    28  C    1.327388
    29  N    0.333953
    30  H   -0.031906
    31  H    0.046468
    32  H   -0.576891
    33  H   -0.458620
    34  H   -0.458224
    35  H   -0.577000
    36  H   -0.031972
    37  H    0.046905
 Sum of Mulliken charges =   3.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C    0.376486
     2  C    0.370395
     3  N    0.653894
     4  Rh  -2.213371
     5  N    0.655419
     6  C    0.370694
     7  C    0.376291
     8  N    0.564533
     9  N    0.564871
    10  N    0.349430
    11  C    0.290308
    28  C    0.292164
    29  N    0.348886
 Electronic spatial extent (au):  <R**2>=           2778.6740
 Charge=              3.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=              0.0016    Y=              0.0350    Z=              0.0018  Tot=              0.0351
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=            -31.5489   YY=            -31.7746   ZZ=            -53.3242
   XY=              0.0117   XZ=              0.1029   YZ=             -0.0021
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=              7.3337   YY=              7.1080   ZZ=            -14.4416
   XY=              0.0117   XZ=              0.1029   YZ=             -0.0021
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=             -2.4519  YYY=             37.5382  ZZZ=              0.0012  XYY=              2.4287
  XXY=            -36.7525  XXZ=             -0.0437  XZZ=             -0.0240  YZZ=             -0.3805
  YYZ=              0.0376  XYZ=             -0.7713
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=          -1006.8917 YYYY=           -974.0328 ZZZZ=           -388.4276 XXXY=              0.3294
 XXXZ=             34.7768 YYYX=              0.0161 YYYZ=              2.4030 ZZZX=              4.6358
 ZZZY=             -0.1143 XXYY=           -327.5907 XXZZ=           -237.1606 YYZZ=           -239.2846
 XXYZ=             -2.3817 YYXZ=            -37.0124 ZZXY=             -0.0974
 N-N= 1.198128431971D+03 E-N=-3.904519791113D+03  KE= 6.075977422160D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Thu Jul  8 21:37:14 2021, MaxMem= 10737418240 cpu:              12.9 elap:               1.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        = 6.58655459D-04 1.43809002D-02 7.25989390D-04
 Polarizability= 1.49422457D+02-4.41604134D-03 1.48319784D+02
                -4.53560410D-02-4.68735167D-05 1.20631710D+02
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 2      0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 3      0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 4      0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 5      0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 6      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000        0.0174    0.0130       -0.0014   -0.0018
 2     -0.0174   -0.0130        0.0008    0.0003       -0.5873   -0.5968
 3      0.0014    0.0018       15.5768   15.5743        0.0003   -0.0003
 4     -0.0008   -0.0003        0.0000    0.0000        0.0023    0.0018
 5    -14.9895  -14.9774       -0.0023   -0.0018        0.0160    0.0130
 6     -0.0003    0.0003       -0.0160   -0.0130       -0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000       -0.0389   -0.0389       -0.0053   -0.0053
 2     -0.0010   -0.0010        0.0000    0.0000       -0.0053   -0.0053
 3     -0.0010   -0.0010       -0.0389   -0.0389        0.0000    0.0000
 4     -0.0389   -0.0389        0.0010    0.0010       -1.7905   -1.7905
 5      0.0053    0.0053       46.7228   46.7228       -0.0010   -0.0010
 6    -44.9323  -44.9323       -0.0053   -0.0053        0.0389    0.0389
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0339    0.0000       -0.1746   -0.0518       -0.0315    0.0071
 2      0.0725    0.0518       -0.0259   -0.0013        2.3326    2.3873
 3     -0.0158   -0.0071      -62.3653  -62.2970       -0.0108    0.0013
 4      0.0415    0.0013       -0.0115    0.0000       -0.0608   -0.0071
 5     59.9246   59.9097        0.0165    0.0071       -0.0583   -0.0518
 6      0.0156   -0.0013        0.0286    0.0518       -0.0096    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.1456    0.0000        4.1599    4.8142        0.2695   -0.1944
 2     -4.7080   -4.8142       -0.1864   -0.1416       -9.0081   -9.7702
 3      0.3643    0.1944        1.4972    0.4464       -0.2500    0.1416
 4      0.2245    0.1416        0.8185    0.0000       -0.0535    0.1944
 5      9.1021    9.3238       -0.2032   -0.1944        5.4300    4.8142
 6     -0.1791   -0.1416       -4.7811   -4.8142       -0.1296    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      6.9215    6.9471       90.4365   90.4069       -0.3315   -0.3837
 2      7.0615    7.0984       96.6493   96.6198       -0.3042   -0.3837
 3      7.0797    7.0984       90.4874   90.4069       -0.3973   -0.4444
 4     -6.2224   -6.2129       -0.1124   -0.1513        3.0882    3.0867
 5     -0.0343   -0.0606      -36.5596  -36.5534        0.1393    0.1513
 6     33.5324   33.4667        0.0314    0.0606        6.0241    6.2129
 Full mass-weighted force constant matrix:
 Low frequencies ---  -13.4836  -11.2898   -6.5340   -0.0004   -0.0003   -0.0002
 Low frequencies ---   84.2247   87.9363  101.8202
 Diagonal vibrational polarizability:
       14.0892078      12.8852557      13.4777204
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   18796.99
                      1                      2                      3
                      A                      A                      A
 Frequencies --     84.1902                87.9342               101.7887
 Red. masses --      2.9562                 2.9808                 2.8609
 Frc consts  --      0.0123                 0.0136                 0.0175
 IR Inten    --      0.0095                 0.0097                 0.0472
 RamAct Fr= 1--      1.1349                 1.0484                 0.1818
  Dep-P Fr= 1--      0.7494                 0.7499                 0.7500
  Dep-U Fr= 1--      0.8568                 0.8571                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0000
 Beta2  Fr= 1--      0.1621                 0.1498                 0.0260
 AlphaG Fr= 1--     -0.0000                -0.0000                 0.0000
 Gamma2 Fr= 1--     -0.4859                -0.2389                 0.1169
 Delta2 Fr= 1--     -0.0762                -0.0577                -0.0109
 Raman1 Fr= 1--       4.539                  4.194                  0.727
 ROA1   Fr= 1--     -49.090                -24.778                 10.870
 CID1   Fr= 1--     -10.814                 -5.908                 14.946
 Raman2 Fr= 1--       1.945                  1.797                  0.312
 ROA2   Fr= 1--     -11.053                 -5.272                  2.892
 CID2   Fr= 1--      -5.684                 -2.933                  9.277
 Raman3 Fr= 1--       3.889                  3.595                  0.623
 ROA3   Fr= 1--     -49.090                -24.778                 10.870
 CID3   Fr= 1--     -12.622                 -6.893                 17.438
 RC180  Fr= 1--       0.714                  0.714                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.07   0.04   0.01    -0.11   0.15   0.08     0.07   0.03  -0.09
     2   6    -0.08   0.09   0.01    -0.02   0.18   0.08    -0.03  -0.03  -0.09
     3   7    -0.08   0.00   0.01     0.01  -0.02  -0.05    -0.05   0.02   0.02
     4  45    -0.02  -0.04   0.01     0.03  -0.02  -0.01     0.01   0.00   0.06
     5   7     0.03  -0.02   0.04     0.07   0.01  -0.03    -0.06  -0.02   0.02
     6   6     0.07   0.19  -0.08     0.06  -0.02   0.03    -0.03   0.03  -0.09
     7   6     0.15   0.14  -0.08     0.00  -0.04   0.03     0.06  -0.04  -0.08
     8   7    -0.03   0.01   0.04     0.01  -0.03   0.02     0.03  -0.09   0.03
     9   7     0.01  -0.02  -0.03     0.03   0.03  -0.02     0.03   0.08   0.04
    10   7     0.04  -0.06   0.02     0.00   0.02   0.02     0.05  -0.04   0.02
    11   6     0.08  -0.07   0.03    -0.14   0.04  -0.02    -0.11   0.04  -0.12
    12   1     0.17   0.29  -0.14    -0.01  -0.07   0.08     0.08  -0.01  -0.14
    13   1     0.31   0.04  -0.09    -0.04  -0.04   0.00     0.12  -0.09  -0.10
    14   1     0.20   0.27  -0.14     0.05  -0.02   0.03    -0.01   0.06  -0.15
    15   1    -0.09   0.29  -0.10     0.09  -0.02   0.06    -0.10   0.07  -0.09
    16   1    -0.15   0.13   0.04    -0.13   0.25   0.14    -0.00  -0.07  -0.16
    17   1    -0.03   0.14  -0.01     0.13   0.26   0.11    -0.10  -0.08  -0.09
    18   1    -0.07   0.10   0.00    -0.13   0.28   0.15     0.08  -0.00  -0.15
    19   1    -0.13  -0.00   0.04    -0.27   0.07   0.08     0.14   0.08  -0.10
    20   1     0.05   0.02  -0.09     0.12   0.11  -0.11     0.00   0.05   0.12
    21   1     0.04  -0.08  -0.03     0.04  -0.09  -0.02     0.03   0.19   0.03
    22   1    -0.14  -0.02  -0.01    -0.10  -0.06  -0.17    -0.02   0.03   0.09
    23   1    -0.07  -0.01   0.01     0.13  -0.12  -0.03    -0.14   0.06   0.02
    24   1     0.15  -0.07   0.16     0.06   0.01  -0.08    -0.03  -0.02   0.09
    25   1    -0.08  -0.11   0.03     0.12   0.05  -0.02    -0.14  -0.05   0.02
    26   1    -0.12   0.11   0.15     0.02  -0.04   0.02     0.01  -0.06   0.11
    27   1    -0.06  -0.12   0.03    -0.01  -0.03   0.01     0.02  -0.19   0.03
    28   6     0.07  -0.01  -0.01    -0.15  -0.07  -0.03    -0.11  -0.03  -0.12
    29   7    -0.02  -0.01  -0.02    -0.03  -0.07  -0.00     0.05   0.04   0.02
    30   1     0.03  -0.10   0.01     0.03   0.09   0.09     0.09  -0.01   0.14
    31   1     0.04  -0.04   0.02     0.06  -0.03  -0.02     0.14  -0.15  -0.05
    32   1     0.07  -0.12   0.05    -0.15   0.14  -0.00    -0.11   0.21  -0.12
    33   1     0.14  -0.07   0.04    -0.21   0.03  -0.04    -0.20  -0.02  -0.22
    34   1     0.09  -0.01   0.00    -0.24  -0.06  -0.06    -0.19   0.03  -0.21
    35   1     0.09   0.04  -0.03    -0.15  -0.17  -0.04    -0.12  -0.20  -0.11
    36   1    -0.04   0.02  -0.08    -0.01  -0.13   0.04     0.09   0.01   0.15
    37   1    -0.06  -0.04   0.00     0.00  -0.01  -0.02     0.15   0.15  -0.04
                      4                      5                      6
                      A                      A                      A
 Frequencies --    144.5414               145.1794               163.0770
 Red. masses --      2.9263                 2.9334                 2.6836
 Frc consts  --      0.0360                 0.0364                 0.0420
 IR Inten    --      0.7408                 0.5929                 0.1302
 RamAct Fr= 1--      0.3639                 0.2393                 1.6663
  Dep-P Fr= 1--      0.7458                 0.6969                 0.7276
  Dep-U Fr= 1--      0.8544                 0.8214                 0.8423
 Alpha2 Fr= 1--      0.0000                 0.0002                 0.0006
 Beta2  Fr= 1--      0.0518                 0.0328                 0.2339
 AlphaG Fr= 1--     -0.0000                -0.0001                -0.0064
 Gamma2 Fr= 1--      0.9357                 0.7591                -1.7727
 Delta2 Fr= 1--      0.2497                 0.1875                -0.5699
 Raman1 Fr= 1--       1.455                  0.957                  6.665
 ROA1   Fr= 1--      97.818                 78.877               -188.418
 CID1   Fr= 1--      67.206                 82.417                -28.269
 Raman2 Fr= 1--       0.622                  0.393                  2.807
 ROA2   Fr= 1--      20.460                 16.719                -37.985
 CID2   Fr= 1--      32.905                 42.537                -13.532
 Raman3 Fr= 1--       1.244                  0.786                  5.614
 ROA3   Fr= 1--      97.818                 78.877               -188.418
 CID3   Fr= 1--      78.658                100.339                -33.560
 RC180  Fr= 1--       0.709                  0.643                  0.685
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.05   0.00   0.07    -0.06   0.09  -0.05    -0.07   0.07   0.01
     2   6     0.05  -0.10   0.06    -0.01  -0.06  -0.07     0.02  -0.09  -0.01
     3   7     0.07  -0.08  -0.03    -0.00  -0.10  -0.09     0.03  -0.07  -0.06
     4  45    -0.01   0.01   0.00    -0.01  -0.02   0.00     0.00   0.00  -0.00
     5   7     0.06   0.12  -0.08     0.05  -0.03   0.04    -0.04  -0.07   0.06
     6   6     0.04   0.11  -0.00     0.05   0.01   0.09    -0.02  -0.09   0.01
     7   6    -0.07  -0.06   0.02     0.02   0.07   0.08     0.07   0.07  -0.01
     8   7    -0.09  -0.09   0.09    -0.01   0.06   0.01     0.06   0.08  -0.08
     9   7    -0.08   0.03   0.08    -0.04   0.11   0.05    -0.06   0.09   0.08
    10   7     0.07  -0.05   0.00    -0.11  -0.04  -0.09     0.10   0.01   0.07
    11   6     0.07  -0.02  -0.05    -0.03  -0.01  -0.13     0.04  -0.00   0.08
    12   1    -0.10  -0.11   0.11     0.02   0.11   0.09     0.09   0.14  -0.08
    13   1    -0.13  -0.11  -0.11     0.03   0.08   0.11     0.13   0.11   0.12
    14   1     0.09   0.17  -0.09     0.07   0.01   0.13    -0.08  -0.15   0.10
    15   1     0.05   0.19   0.13     0.04   0.01   0.07    -0.01  -0.18  -0.11
    16   1     0.10  -0.13   0.02    -0.00  -0.09  -0.15     0.07  -0.15  -0.10
    17   1     0.06  -0.15   0.15    -0.00  -0.11   0.03     0.00  -0.18   0.11
    18   1    -0.07   0.02   0.14    -0.07   0.16  -0.00    -0.09   0.14   0.09
    19   1    -0.08   0.04  -0.01    -0.10   0.14  -0.15    -0.13   0.12  -0.12
    20   1    -0.07   0.02   0.16    -0.01   0.11   0.17    -0.03   0.09   0.18
    21   1    -0.15   0.08   0.07    -0.09   0.20   0.04    -0.11   0.17   0.07
    22   1     0.10  -0.05  -0.14    -0.01  -0.08  -0.18     0.06  -0.06  -0.13
    23   1     0.13  -0.16  -0.02     0.01  -0.20  -0.07     0.06  -0.14  -0.06
    24   1     0.08   0.09  -0.22     0.07  -0.03   0.05    -0.06  -0.05   0.13
    25   1     0.11   0.24  -0.06     0.08  -0.05   0.04    -0.06  -0.14   0.05
    26   1    -0.06  -0.08   0.23    -0.04   0.07  -0.02     0.03   0.09  -0.17
    27   1    -0.18  -0.19   0.08    -0.03   0.10   0.01     0.11   0.16  -0.07
    28   6     0.04   0.02  -0.12     0.07   0.00   0.07    -0.04  -0.00  -0.08
    29   7    -0.02   0.06  -0.06     0.13  -0.01   0.07    -0.09   0.01  -0.07
    30   1     0.08  -0.09   0.07    -0.14  -0.04  -0.20     0.12  -0.01   0.16
    31   1     0.12  -0.06  -0.03    -0.21  -0.07  -0.04     0.18   0.02   0.03
    32   1     0.03  -0.02  -0.01     0.08   0.03  -0.25    -0.05  -0.03   0.18
    33   1     0.12  -0.04  -0.07    -0.14  -0.03  -0.18     0.13   0.00   0.11
    34   1     0.00   0.05  -0.17     0.19  -0.01   0.10    -0.14   0.01  -0.11
    35   1     0.08  -0.01  -0.17    -0.04   0.04   0.19     0.05  -0.04  -0.18
    36   1    -0.03   0.09  -0.08     0.16   0.02   0.19    -0.11  -0.01  -0.15
    37   1    -0.04   0.09  -0.05     0.23  -0.03   0.01    -0.17   0.03  -0.03
                      7                      8                      9
                      A                      A                      A
 Frequencies --    215.2628               217.8485               221.5678
 Red. masses --      2.8013                 2.7824                 2.9697
 Frc consts  --      0.0765                 0.0778                 0.0859
 IR Inten    --      4.4550                 5.9166                15.5955
 RamAct Fr= 1--      3.0281                 3.0953                 0.0915
  Dep-P Fr= 1--      0.7273                 0.7500                 0.7312
  Dep-U Fr= 1--      0.8421                 0.8571                 0.8448
 Alpha2 Fr= 1--      0.0012                 0.0000                 0.0000
 Beta2  Fr= 1--      0.4250                 0.4422                 0.0129
 AlphaG Fr= 1--     -0.0054                 0.0000                 0.0000
 Gamma2 Fr= 1--     -0.2587                -0.4844                -0.1289
 Delta2 Fr= 1--      0.1570                 0.0559                -0.0306
 Raman1 Fr= 1--      12.112                 12.381                  0.366
 ROA1   Fr= 1--     -19.808                -44.711                -13.348
 CID1   Fr= 1--      -1.635                 -3.611                -36.486
 Raman2 Fr= 1--       5.100                  5.306                  0.155
 ROA2   Fr= 1--      -7.464                -12.073                 -2.848
 CID2   Fr= 1--      -1.464                 -2.275                -18.430
 Raman3 Fr= 1--      10.200                 10.613                  0.309
 ROA3   Fr= 1--     -19.808                -44.711                -13.348
 CID3   Fr= 1--      -1.942                 -4.213                -43.191
 RC180  Fr= 1--       0.684                  0.714                  0.690
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.01  -0.01    -0.07  -0.08  -0.00     0.00   0.04  -0.04
     2   6    -0.09  -0.00  -0.01    -0.05  -0.01  -0.00    -0.01   0.03  -0.04
     3   7    -0.11   0.10   0.10    -0.04  -0.06  -0.06    -0.01  -0.10  -0.04
     4  45     0.00  -0.01  -0.00    -0.01   0.00   0.02     0.00  -0.00   0.07
     5   7     0.11   0.09  -0.09    -0.03   0.07  -0.06    -0.00   0.10  -0.04
     6   6     0.09  -0.00   0.01    -0.05   0.01   0.00    -0.01  -0.03  -0.04
     7   6    -0.01   0.00   0.01    -0.06   0.08  -0.00    -0.00  -0.03  -0.04
     8   7     0.06   0.07  -0.08     0.00   0.13  -0.05     0.11   0.03  -0.04
     9   7    -0.06   0.08   0.09    -0.00  -0.12  -0.05     0.10  -0.03  -0.04
    10   7     0.02  -0.07  -0.02     0.14  -0.03   0.08    -0.12  -0.06  -0.04
    11   6     0.01  -0.10   0.02     0.02   0.03  -0.02     0.02  -0.06  -0.04
    12   1    -0.04  -0.07   0.10    -0.06   0.04   0.00     0.00  -0.12  -0.03
    13   1    -0.12   0.06  -0.01    -0.11   0.13   0.03    -0.08   0.01  -0.03
    14   1     0.04  -0.03   0.05    -0.09  -0.03   0.07    -0.10  -0.07  -0.04
    15   1     0.18  -0.04   0.05     0.02  -0.05  -0.03     0.07  -0.08  -0.03
    16   1    -0.04  -0.04  -0.05    -0.09   0.03   0.06    -0.10   0.07  -0.04
    17   1    -0.19  -0.04  -0.05     0.01   0.05  -0.03     0.07   0.07  -0.03
    18   1     0.04  -0.07  -0.10    -0.06  -0.04  -0.00     0.01   0.12  -0.04
    19   1     0.13   0.06   0.01    -0.11  -0.12   0.03    -0.07  -0.01  -0.03
    20   1    -0.08   0.03   0.24    -0.00  -0.10  -0.16     0.12   0.01  -0.17
    21   1    -0.13   0.21   0.07     0.06  -0.20  -0.04     0.21  -0.12  -0.02
    22   1    -0.08   0.10   0.26    -0.06  -0.06  -0.16    -0.05  -0.11  -0.18
    23   1    -0.19   0.25   0.08     0.01  -0.16  -0.04     0.01  -0.25  -0.02
    24   1     0.08   0.09  -0.25    -0.06   0.07  -0.17    -0.05   0.11  -0.18
    25   1     0.20   0.23  -0.07     0.02   0.17  -0.05     0.02   0.25  -0.02
    26   1     0.08   0.03  -0.23     0.01   0.10  -0.17     0.13  -0.01  -0.18
    27   1     0.13   0.19  -0.07     0.07   0.21  -0.04     0.22   0.12  -0.02
    28   6    -0.01  -0.10  -0.02     0.02  -0.04  -0.02     0.02   0.06  -0.04
    29   7    -0.02  -0.07   0.02     0.14   0.02   0.08    -0.12   0.06  -0.04
    30   1     0.02  -0.07  -0.01     0.18  -0.05   0.25    -0.16  -0.09  -0.18
    31   1     0.02  -0.05  -0.02     0.28  -0.08  -0.01    -0.25  -0.06   0.04
    32   1    -0.02  -0.14   0.05     0.02   0.18  -0.02     0.02  -0.15  -0.04
    33   1     0.04  -0.08   0.06    -0.06  -0.01  -0.10     0.10  -0.07  -0.03
    34   1    -0.05  -0.08  -0.06    -0.06   0.01  -0.10     0.09   0.06  -0.05
    35   1     0.01  -0.13  -0.05     0.01  -0.18  -0.02     0.03   0.14  -0.05
    36   1    -0.02  -0.08   0.01     0.18   0.04   0.25    -0.16   0.09  -0.18
    37   1    -0.03  -0.06   0.02     0.28   0.07  -0.00    -0.25   0.07   0.04
                     10                     11                     12
                      A                      A                      A
 Frequencies --    249.8713               290.3703               302.3422
 Red. masses --      4.7062                 2.0253                 2.0123
 Frc consts  --      0.1731                 0.1006                 0.1084
 IR Inten    --      0.0317                 1.6767                 1.5088
 RamAct Fr= 1--     17.6471                 1.0037                 2.0862
  Dep-P Fr= 1--      0.0774                 0.7460                 0.5192
  Dep-U Fr= 1--      0.1437                 0.8546                 0.6835
 Alpha2 Fr= 1--      0.3264                 0.0001                 0.0094
 Beta2  Fr= 1--      0.4226                 0.1429                 0.2377
 AlphaG Fr= 1--      0.1557                -0.0001                -0.0310
 Gamma2 Fr= 1--      5.0661                 0.2872                -1.4921
 Delta2 Fr= 1--      0.4835                -0.1811                -0.2639
 Raman1 Fr= 1--      70.589                  4.015                  8.345
 ROA1   Fr= 1--     501.815                 21.776               -151.683
 CID1   Fr= 1--       7.109                  5.424                -18.177
 Raman2 Fr= 1--       5.071                  1.715                  2.852
 ROA2   Fr= 1--     117.717                  8.342                -33.699
 CID2   Fr= 1--      23.215                  4.863                -11.816
 Raman3 Fr= 1--      10.142                  3.431                  5.704
 ROA3   Fr= 1--     501.815                 21.776               -151.683
 CID3   Fr= 1--      49.481                  6.347                -26.593
 RC180  Fr= 1--      -0.713                  0.709                  0.367
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.15  -0.09   0.01    -0.11   0.04   0.00    -0.10   0.04   0.01
     2   6    -0.16  -0.08   0.00    -0.04  -0.11  -0.01     0.01  -0.09  -0.00
     3   7    -0.15  -0.00  -0.01    -0.04   0.03   0.02     0.01   0.07   0.01
     4  45     0.00  -0.00   0.00     0.04  -0.00   0.00     0.00   0.04   0.00
     5   7     0.15  -0.01   0.01    -0.04  -0.04   0.03    -0.01   0.07  -0.01
     6   6     0.16  -0.09  -0.00    -0.03   0.12  -0.01    -0.02  -0.08   0.00
     7   6     0.14  -0.10  -0.01    -0.11  -0.04   0.00     0.09   0.03  -0.01
     8   7     0.09  -0.11  -0.03     0.05   0.04  -0.00    -0.03  -0.04   0.06
     9   7    -0.09  -0.11   0.03     0.04  -0.04   0.00     0.03  -0.04  -0.06
    10   7    -0.01   0.12   0.05    -0.00   0.03  -0.02     0.01  -0.04  -0.04
    11   6    -0.01   0.18  -0.02    -0.00   0.01   0.01    -0.01  -0.06  -0.02
    12   1     0.13  -0.05   0.02    -0.14  -0.24   0.10     0.12   0.17  -0.12
    13   1     0.16  -0.11  -0.01    -0.30  -0.00  -0.12     0.25  -0.01   0.09
    14   1     0.09  -0.12  -0.01     0.12   0.23  -0.13    -0.16  -0.18   0.09
    15   1     0.20  -0.12   0.00    -0.15   0.27   0.10     0.08  -0.21  -0.09
    16   1    -0.10  -0.11   0.01     0.09  -0.21  -0.12     0.16  -0.20  -0.10
    17   1    -0.20  -0.11  -0.00    -0.15  -0.24   0.09    -0.11  -0.23   0.10
    18   1    -0.14  -0.05  -0.02    -0.12   0.22   0.09    -0.13   0.20   0.13
    19   1    -0.17  -0.11   0.01    -0.27   0.01  -0.10    -0.28   0.01  -0.10
    20   1    -0.08  -0.10   0.03     0.11   0.02  -0.08     0.07   0.02  -0.23
    21   1    -0.09  -0.11   0.03     0.08  -0.12   0.01     0.10  -0.19  -0.04
    22   1    -0.13   0.00   0.03     0.02   0.05   0.14     0.10   0.10   0.12
    23   1    -0.16   0.04  -0.02    -0.10   0.13   0.01    -0.05   0.16   0.00
    24   1     0.12  -0.00  -0.03     0.03  -0.06   0.17    -0.10   0.10  -0.11
    25   1     0.16   0.04   0.02    -0.12  -0.15   0.01     0.05   0.15  -0.00
    26   1     0.08  -0.10  -0.03     0.12  -0.03  -0.10    -0.06   0.02   0.22
    27   1     0.09  -0.11  -0.03     0.10   0.13   0.01    -0.10  -0.18   0.05
    28   6     0.02   0.18   0.02    -0.00  -0.01   0.00     0.01  -0.06   0.02
    29   7     0.01   0.12  -0.05    -0.00  -0.02  -0.02    -0.01  -0.04   0.04
    30   1    -0.01   0.13   0.04    -0.01   0.06  -0.07     0.02  -0.04  -0.02
    31   1    -0.03   0.07   0.05    -0.05   0.03   0.00     0.02  -0.05  -0.05
    32   1     0.02   0.25  -0.06    -0.00  -0.01   0.01     0.01  -0.06  -0.05
    33   1    -0.06   0.13  -0.10    -0.00   0.03   0.03    -0.04  -0.05  -0.01
    34   1     0.07   0.13   0.10    -0.01  -0.02   0.02     0.04  -0.05   0.01
    35   1    -0.01   0.25   0.06     0.00   0.01  -0.00    -0.01  -0.05   0.05
    36   1     0.01   0.13  -0.05    -0.01  -0.06  -0.07    -0.02  -0.05   0.01
    37   1     0.02   0.07  -0.05    -0.04  -0.02  -0.00    -0.03  -0.05   0.05
                     13                     14                     15
                      A                      A                      A
 Frequencies --    306.5561               330.0604               331.5285
 Red. masses --      1.8432                 3.0968                 3.1757
 Frc consts  --      0.1021                 0.1988                 0.2057
 IR Inten    --      0.7089                 6.2467                 7.4720
 RamAct Fr= 1--      1.4018                 2.6140                 2.5803
  Dep-P Fr= 1--      0.1542                 0.7451                 0.7492
  Dep-U Fr= 1--      0.2672                 0.8540                 0.8566
 Alpha2 Fr= 1--      0.0214                 0.0002                 0.0000
 Beta2  Fr= 1--      0.0624                 0.3720                 0.3684
 AlphaG Fr= 1--      0.0432                -0.0018                -0.0002
 Gamma2 Fr= 1--      0.1123                -2.0455                -3.1736
 Delta2 Fr= 1--     -0.0853                -0.1790                -0.0626
 Raman1 Fr= 1--       5.607                 10.456                 10.321
 ROA1   Fr= 1--       8.050               -202.094               -306.670
 CID1   Fr= 1--       1.436                -19.328                -29.713
 Raman2 Fr= 1--       0.749                  4.465                  4.421
 ROA2   Fr= 1--       3.377                -47.660                -75.665
 CID2   Fr= 1--       4.508                -10.675                -17.116
 Raman3 Fr= 1--       1.498                  8.929                  8.842
 ROA3   Fr= 1--       8.050               -202.094               -306.670
 CID3   Fr= 1--       5.373                -22.633                -34.685
 RC180  Fr= 1--      -0.466                  0.708                  0.713
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03   0.03   0.01    -0.02  -0.06  -0.00    -0.02  -0.10   0.00
     2   6     0.02  -0.01   0.01     0.00   0.03  -0.00    -0.12   0.03   0.00
     3   7     0.01   0.01   0.04     0.02  -0.00  -0.09    -0.10  -0.06  -0.06
     4  45     0.00  -0.02  -0.00    -0.02   0.08   0.00     0.09   0.02  -0.00
     5   7    -0.01   0.01  -0.04     0.03  -0.03   0.10    -0.09   0.05  -0.00
     6   6    -0.02  -0.00  -0.01     0.06   0.03  -0.00    -0.11  -0.00   0.00
     7   6    -0.03   0.03  -0.01     0.03  -0.10   0.00    -0.01   0.06   0.00
     8   7    -0.03   0.03  -0.01     0.11  -0.04  -0.02    -0.03   0.02   0.09
     9   7     0.03   0.03   0.01    -0.08  -0.02  -0.02    -0.08  -0.03   0.10
    10   7     0.07  -0.04   0.05     0.06  -0.10  -0.01    -0.00   0.02  -0.06
    11   6    -0.04   0.06  -0.10    -0.03  -0.08  -0.06    -0.00  -0.01  -0.02
    12   1    -0.03   0.03  -0.01     0.00  -0.21   0.08     0.03   0.10  -0.11
    13   1    -0.03   0.04  -0.00    -0.09  -0.09  -0.08     0.08   0.04   0.06
    14   1    -0.03  -0.02   0.03     0.12   0.10  -0.13    -0.16  -0.05   0.05
    15   1     0.00  -0.03  -0.03    -0.02   0.14   0.07    -0.07  -0.07  -0.06
    16   1     0.03  -0.02  -0.03    -0.02   0.07   0.09    -0.20   0.11   0.11
    17   1    -0.01  -0.03   0.03     0.06   0.09  -0.04    -0.04   0.14  -0.09
    18   1     0.03   0.04   0.01    -0.02  -0.14  -0.02     0.02  -0.20  -0.14
    19   1     0.03   0.04  -0.00     0.04  -0.06   0.04     0.12  -0.08   0.10
    20   1     0.04   0.04   0.01    -0.14  -0.06  -0.05    -0.11  -0.09   0.30
    21   1     0.02   0.03   0.01    -0.06  -0.03  -0.02    -0.21   0.14   0.07
    22   1     0.02   0.00   0.10     0.01   0.01  -0.26    -0.17  -0.08  -0.18
    23   1    -0.01   0.06   0.03     0.09  -0.17  -0.07    -0.04  -0.20  -0.04
    24   1    -0.02   0.00  -0.10     0.07  -0.03   0.31    -0.15   0.08  -0.03
    25   1     0.01   0.06  -0.03    -0.07  -0.23   0.08    -0.08   0.09   0.00
    26   1    -0.04   0.04  -0.02     0.16  -0.10  -0.09    -0.02   0.05   0.28
    27   1    -0.02   0.03  -0.01     0.16   0.03  -0.02    -0.16  -0.13   0.07
    28   6     0.05   0.06   0.10     0.02  -0.08   0.06     0.01  -0.03   0.01
    29   7    -0.08  -0.04  -0.06    -0.06  -0.08   0.04    -0.04  -0.07  -0.05
    30   1     0.13  -0.04   0.24     0.10  -0.14   0.16    -0.02   0.07  -0.15
    31   1     0.23  -0.15  -0.05     0.20  -0.16  -0.09    -0.10   0.00  -0.01
    32   1     0.07   0.29  -0.23     0.03   0.02  -0.13     0.02  -0.02  -0.04
    33   1    -0.26  -0.02  -0.26    -0.15  -0.10  -0.11    -0.03   0.02   0.01
    34   1     0.26  -0.03   0.26     0.15  -0.09   0.09     0.04  -0.07   0.06
    35   1    -0.05   0.30   0.23    -0.04   0.01   0.14     0.00   0.03   0.02
    36   1    -0.13  -0.04  -0.25    -0.08  -0.08  -0.06    -0.08  -0.12  -0.21
    37   1    -0.25  -0.14   0.05    -0.13  -0.13   0.09    -0.19  -0.07   0.04
                     16                     17                     18
                      A                      A                      A
 Frequencies --    400.7955               402.0299               404.3493
 Red. masses --      4.4782                 3.7781                 4.5721
 Frc consts  --      0.4238                 0.3598                 0.4404
 IR Inten    --      1.4590                 0.4357                 1.8170
 RamAct Fr= 1--      0.8891                 4.5246                 3.8709
  Dep-P Fr= 1--      0.7492                 0.7449                 0.7500
  Dep-U Fr= 1--      0.8566                 0.8538                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0004                 0.0000
 Beta2  Fr= 1--      0.1269                 0.6439                 0.5530
 AlphaG Fr= 1--      0.0000                 0.0060                 0.0000
 Gamma2 Fr= 1--     -0.6410                 1.2692                -0.6013
 Delta2 Fr= 1--     -0.0665                 0.0979                 0.2062
 Raman1 Fr= 1--       3.556                 18.098                 15.484
 ROA1   Fr= 1--     -63.660                124.979                -51.122
 CID1   Fr= 1--     -17.900                  6.905                 -3.302
 Raman2 Fr= 1--       1.523                  7.726                  6.636
 ROA2   Fr= 1--     -14.851                 29.679                -16.080
 CID2   Fr= 1--      -9.750                  3.841                 -2.423
 Raman3 Fr= 1--       3.046                 15.453                 13.271
 ROA3   Fr= 1--     -63.660                124.979                -51.122
 CID3   Fr= 1--     -20.897                  8.088                 -3.852
 RC180  Fr= 1--       0.713                  0.708                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.04  -0.02  -0.04     0.08   0.04   0.07    -0.09  -0.04  -0.05
     2   6     0.05   0.03  -0.04    -0.09  -0.06   0.06     0.05   0.03  -0.05
     3   7     0.05   0.09  -0.05    -0.10  -0.15   0.09     0.06   0.09  -0.04
     4  45    -0.02  -0.00   0.10    -0.00   0.07   0.00     0.08   0.00   0.04
     5   7     0.04  -0.07  -0.04     0.09  -0.15  -0.08     0.07  -0.12  -0.06
     6   6     0.04  -0.03  -0.03     0.08  -0.07  -0.06     0.06  -0.04  -0.06
     7   6    -0.03   0.01  -0.03    -0.07   0.04  -0.06    -0.10   0.05  -0.06
     8   7    -0.08  -0.01  -0.04    -0.14   0.01  -0.06    -0.18   0.01  -0.10
     9   7    -0.09   0.01  -0.05     0.15   0.00   0.07    -0.16  -0.01  -0.09
    10   7     0.06   0.18  -0.12    -0.02  -0.00   0.00    -0.06  -0.12   0.10
    11   6     0.08   0.12  -0.04     0.01  -0.01   0.00    -0.04  -0.07   0.02
    12   1    -0.05   0.06   0.02    -0.11   0.06   0.06    -0.15   0.10   0.08
    13   1    -0.02   0.00  -0.04    -0.10   0.02  -0.11    -0.13   0.04  -0.11
    14   1     0.08  -0.03   0.03     0.13  -0.09   0.08     0.11  -0.07   0.06
    15   1     0.03  -0.03  -0.04     0.09  -0.11  -0.11     0.07  -0.07  -0.10
    16   1     0.10   0.03   0.04    -0.14  -0.09  -0.09     0.09   0.05   0.05
    17   1     0.04   0.04  -0.05    -0.10  -0.11   0.12     0.06   0.05  -0.09
    18   1    -0.06  -0.07   0.03     0.13   0.07  -0.06    -0.14  -0.08   0.07
    19   1    -0.03  -0.00  -0.05     0.11   0.02   0.12    -0.12  -0.03  -0.10
    20   1    -0.15  -0.01  -0.12     0.13   0.03  -0.14    -0.19  -0.04  -0.02
    21   1    -0.01  -0.02  -0.03     0.27  -0.14   0.09    -0.23   0.04  -0.10
    22   1     0.11   0.12  -0.14    -0.11  -0.13  -0.10     0.06   0.08   0.05
    23   1     0.05  -0.00  -0.04    -0.07  -0.33   0.11    -0.01   0.15  -0.05
    24   1     0.09  -0.11  -0.15     0.11  -0.13   0.08     0.08  -0.10   0.06
    25   1     0.04   0.03  -0.02     0.06  -0.31  -0.11    -0.00  -0.20  -0.07
    26   1    -0.14   0.02  -0.14    -0.11   0.03   0.13    -0.20   0.05  -0.00
    27   1     0.02   0.03  -0.02    -0.24  -0.12  -0.08    -0.27  -0.05  -0.11
    28   6     0.07  -0.12  -0.04     0.00  -0.03  -0.01    -0.04   0.08   0.02
    29   7     0.05  -0.18  -0.12     0.03  -0.04  -0.02    -0.05   0.12   0.10
    30   1     0.01   0.22  -0.30    -0.02  -0.06   0.02    -0.08  -0.08   0.02
    31   1    -0.11   0.19  -0.02    -0.01  -0.00  -0.00    -0.14  -0.20   0.13
    32   1     0.13   0.15  -0.10     0.01  -0.02   0.01    -0.06  -0.07   0.04
    33   1    -0.08   0.20   0.03     0.02  -0.01   0.01     0.04  -0.14  -0.05
    34   1    -0.09  -0.19   0.03    -0.03  -0.04  -0.00     0.04   0.13  -0.05
    35   1     0.12  -0.15  -0.10     0.01  -0.04  -0.02    -0.06   0.07   0.04
    36   1    -0.00  -0.21  -0.30     0.03  -0.09  -0.05    -0.07   0.08   0.02
    37   1    -0.13  -0.18  -0.02     0.01  -0.04  -0.01    -0.13   0.20   0.13
                     19                     20                     21
                      A                      A                      A
 Frequencies --    460.5852               464.1120               503.6166
 Red. masses --      3.8719                 4.1367                 4.3001
 Frc consts  --      0.4839                 0.5250                 0.6426
 IR Inten    --      6.8792                 7.8452                 0.0002
 RamAct Fr= 1--      5.0462                 5.5703                48.4833
  Dep-P Fr= 1--      0.7500                 0.7350                 0.0026
  Dep-U Fr= 1--      0.8571                 0.8472                 0.0051
 Alpha2 Fr= 1--      0.0000                 0.0014                 1.0710
 Beta2  Fr= 1--      0.7209                 0.7866                 0.0413
 AlphaG Fr= 1--     -0.0000                 0.0223                -0.4455
 Gamma2 Fr= 1--      1.1376                 1.9371                -1.1316
 Delta2 Fr= 1--     -0.0561                -0.1410                 0.1146
 Raman1 Fr= 1--      20.185                 22.281                193.933
 ROA1   Fr= 1--     107.413                181.448               -104.968
 CID1   Fr= 1--       5.321                  8.143                 -0.541
 Raman2 Fr= 1--       8.651                  9.439                  0.496
 ROA2   Fr= 1--      27.751                 47.618                -28.075
 CID2   Fr= 1--       3.208                  5.045                -56.601
 Raman3 Fr= 1--      17.301                 18.877                  0.992
 ROA3   Fr= 1--     107.413                181.448               -104.968
 CID3   Fr= 1--       6.208                  9.612               -105.810
 RC180  Fr= 1--       0.714                  0.694                 -0.990
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.04   0.01    -0.01   0.01  -0.01     0.00  -0.02   0.01
     2   6     0.02  -0.02   0.02     0.04   0.00  -0.01    -0.02   0.01  -0.00
     3   7    -0.03  -0.18   0.18     0.01  -0.03   0.07     0.02   0.14  -0.15
     4  45     0.03   0.00  -0.01    -0.00   0.03   0.00     0.00   0.00  -0.00
     5   7    -0.02   0.17   0.17    -0.01  -0.05  -0.09    -0.02   0.14   0.15
     6   6     0.01   0.02   0.02    -0.04   0.00   0.00     0.02   0.01   0.00
     7   6     0.02  -0.04   0.01     0.01   0.01   0.01    -0.00  -0.02  -0.01
     8   7    -0.10  -0.06  -0.15     0.12   0.04   0.13    -0.14  -0.05  -0.15
     9   7    -0.11   0.07  -0.16    -0.11   0.04  -0.11     0.14  -0.06   0.15
    10   7     0.01   0.02   0.01    -0.15  -0.10   0.21    -0.09  -0.08   0.15
    11   6     0.02   0.04  -0.01     0.00   0.02   0.04     0.00   0.01   0.02
    12   1    -0.01   0.08   0.07     0.04  -0.08  -0.07    -0.04   0.11   0.06
    13   1     0.05  -0.06   0.01    -0.00   0.04   0.03     0.03  -0.05  -0.02
    14   1    -0.11   0.01  -0.10     0.03   0.02   0.04    -0.11  -0.03  -0.07
    15   1     0.04   0.02   0.05    -0.04   0.01   0.00     0.06  -0.02   0.00
    16   1    -0.12   0.00  -0.10    -0.01   0.02  -0.03     0.10  -0.03   0.07
    17   1     0.05  -0.02   0.05     0.04   0.01  -0.01    -0.06  -0.02  -0.00
    18   1    -0.02  -0.09   0.07    -0.05  -0.07   0.06     0.04   0.10  -0.06
    19   1     0.05   0.06   0.00     0.00   0.03  -0.03    -0.04  -0.05   0.02
    20   1    -0.14   0.06  -0.26    -0.15   0.03  -0.16     0.15  -0.06   0.20
    21   1    -0.13  -0.06  -0.17    -0.10  -0.02  -0.11     0.12   0.02   0.14
    22   1    -0.08  -0.21   0.30     0.01  -0.04   0.11     0.03   0.15  -0.19
    23   1    -0.12  -0.09   0.17    -0.05  -0.02   0.07     0.10   0.09  -0.15
    24   1    -0.07   0.21   0.28    -0.00  -0.06  -0.15    -0.02   0.15   0.20
    25   1    -0.11   0.09   0.16     0.07  -0.03  -0.09    -0.09   0.10   0.15
    26   1    -0.13  -0.05  -0.25     0.16   0.03   0.19    -0.15  -0.05  -0.20
    27   1    -0.11   0.07  -0.15     0.12  -0.04   0.13    -0.12   0.03  -0.15
    28   6     0.02  -0.03  -0.01    -0.01   0.03  -0.04    -0.00   0.01  -0.02
    29   7     0.02  -0.03  -0.01     0.14  -0.11  -0.21     0.09  -0.09  -0.15
    30   1    -0.01   0.03  -0.08    -0.19  -0.20   0.12    -0.13  -0.10   0.03
    31   1    -0.07  -0.00   0.05    -0.22  -0.14   0.25    -0.18  -0.10   0.20
    32   1     0.05   0.09  -0.04    -0.01   0.06   0.05    -0.00   0.06   0.02
    33   1    -0.04   0.02  -0.04     0.07  -0.10  -0.11     0.03  -0.08  -0.09
    34   1    -0.05  -0.03  -0.03    -0.07  -0.09   0.11    -0.03  -0.08   0.09
    35   1     0.05  -0.08  -0.04     0.01   0.07  -0.05     0.00   0.06  -0.02
    36   1     0.00  -0.05  -0.09     0.18  -0.20  -0.11     0.13  -0.10  -0.03
    37   1    -0.05  -0.01   0.03     0.23  -0.15  -0.26     0.17  -0.11  -0.20
                     22                     23                     24
                      A                      A                      A
 Frequencies --    534.0340               543.7142               558.9321
 Red. masses --      1.6472                 1.7309                 1.8293
 Frc consts  --      0.2768                 0.3015                 0.3367
 IR Inten    --      2.3516                 2.1009                 3.5653
 RamAct Fr= 1--      0.1320                 0.3298                 0.3129
  Dep-P Fr= 1--      0.7497                 0.7495                 0.6474
  Dep-U Fr= 1--      0.8570                 0.8568                 0.7860
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0006
 Beta2  Fr= 1--      0.0189                 0.0471                 0.0410
 AlphaG Fr= 1--      0.0000                -0.0000                -0.0056
 Gamma2 Fr= 1--     -0.2043                 0.5912                -0.7390
 Delta2 Fr= 1--     -0.0397                 0.3540                -0.1703
 Raman1 Fr= 1--       0.528                  1.319                  1.251
 ROA1   Fr= 1--     -20.880                 68.081                -76.396
 CID1   Fr= 1--     -39.538                 51.615                -61.048
 Raman2 Fr= 1--       0.226                  0.565                  0.492
 ROA2   Fr= 1--      -4.585                 11.356                -16.374
 CID2   Fr= 1--     -20.262                 20.097                -33.294
 Raman3 Fr= 1--       0.453                  1.130                  0.984
 ROA3   Fr= 1--     -20.880                 68.081                -76.396
 CID3   Fr= 1--     -46.137                 60.241                -77.672
 RC180  Fr= 1--       0.714                  0.714                  0.572
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.05  -0.03  -0.06    -0.00  -0.00   0.00     0.05   0.04   0.06
     2   6     0.06   0.03  -0.06     0.00   0.00  -0.00    -0.05  -0.02   0.06
     3   7     0.03  -0.05   0.05     0.00   0.00  -0.01    -0.02   0.06  -0.07
     4  45    -0.01  -0.00  -0.00    -0.01  -0.00  -0.02    -0.00  -0.03   0.00
     5   7     0.03   0.05   0.06     0.00  -0.00  -0.01     0.02   0.05   0.07
     6   6     0.06  -0.03  -0.06     0.00  -0.00  -0.00     0.05  -0.02  -0.06
     7   6    -0.05   0.03  -0.06    -0.00   0.00  -0.00    -0.05   0.04  -0.06
     8   7     0.02   0.04   0.05     0.02   0.01   0.02     0.04   0.05   0.07
     9   7     0.02  -0.04   0.04     0.02  -0.01   0.02    -0.04   0.05  -0.07
    10   7     0.00   0.02  -0.02    -0.05  -0.00   0.10     0.00   0.01  -0.00
    11   6     0.00   0.00   0.00     0.08   0.08  -0.02    -0.00   0.00   0.00
    12   1    -0.10  -0.15   0.09     0.00  -0.04   0.00    -0.09  -0.18   0.09
    13   1    -0.23   0.05  -0.19    -0.02   0.01  -0.01    -0.25   0.07  -0.20
    14   1    -0.10  -0.16   0.09    -0.01  -0.02   0.02    -0.13  -0.16   0.10
    15   1     0.17  -0.19  -0.18     0.02  -0.02  -0.02     0.16  -0.20  -0.20
    16   1    -0.09   0.15   0.08    -0.01   0.02   0.02     0.12  -0.17  -0.10
    17   1     0.17   0.17  -0.17     0.02   0.02  -0.01    -0.18  -0.20   0.21
    18   1    -0.09   0.15   0.09     0.00   0.03  -0.00     0.09  -0.19  -0.10
    19   1    -0.22  -0.04  -0.19    -0.02  -0.01  -0.01     0.26   0.06   0.21
    20   1     0.06  -0.05   0.25     0.02  -0.01   0.05    -0.04   0.08  -0.21
    21   1    -0.06   0.15   0.03    -0.00   0.02   0.02    -0.01  -0.11  -0.06
    22   1     0.01  -0.08   0.24    -0.02  -0.02   0.09    -0.03   0.07  -0.22
    23   1    -0.09   0.11   0.03     0.01   0.11  -0.03     0.11  -0.07  -0.05
    24   1     0.02   0.09   0.25    -0.01   0.02   0.10     0.03   0.07   0.21
    25   1    -0.10  -0.11   0.04    -0.00  -0.11  -0.03    -0.11  -0.06   0.05
    26   1     0.06   0.05   0.25     0.03   0.01   0.06     0.04   0.07   0.20
    27   1    -0.07  -0.15   0.03    -0.00  -0.02   0.02     0.01  -0.11   0.06
    28   6     0.00  -0.00   0.00     0.08  -0.08  -0.02    -0.00   0.00   0.00
    29   7     0.00  -0.02  -0.02    -0.05   0.00   0.10    -0.00   0.01   0.00
    30   1     0.02  -0.03   0.07    -0.13  -0.06  -0.15    -0.01   0.03  -0.05
    31   1     0.09   0.04  -0.07    -0.26  -0.01   0.22    -0.04  -0.00   0.02
    32   1    -0.01  -0.03   0.01     0.22   0.33  -0.19    -0.00   0.00   0.00
    33   1     0.02   0.02   0.03    -0.21  -0.01  -0.21    -0.00   0.00   0.00
    34   1     0.02  -0.02   0.03    -0.21   0.02  -0.21     0.01   0.00  -0.00
    35   1    -0.00   0.03   0.01     0.21  -0.34  -0.19    -0.00   0.01   0.00
    36   1     0.03   0.03   0.07    -0.13   0.07  -0.14     0.01   0.03   0.05
    37   1     0.09  -0.05  -0.07    -0.26   0.03   0.22     0.04  -0.00  -0.02
                     25                     26                     27
                      A                      A                      A
 Frequencies --    680.5897               686.1545               714.9917
 Red. masses --      1.3007                 1.3081                 1.2854
 Frc consts  --      0.3550                 0.3629                 0.3871
 IR Inten    --      1.8806                 0.8007                 1.2751
 RamAct Fr= 1--      1.7882                 0.0626                 0.8821
  Dep-P Fr= 1--      0.0157                 0.7350                 0.5483
  Dep-U Fr= 1--      0.0309                 0.8473                 0.7083
 Alpha2 Fr= 1--      0.0383                 0.0000                 0.0034
 Beta2  Fr= 1--      0.0092                 0.0088                 0.1041
 AlphaG Fr= 1--      0.0155                -0.0000                 0.1001
 Gamma2 Fr= 1--      0.6773                 0.7664                -2.7476
 Delta2 Fr= 1--     -0.0842                -0.0465                 0.0246
 Raman1 Fr= 1--       7.153                  0.250                  3.529
 ROA1   Fr= 1--      62.327                 72.088               -262.981
 CID1   Fr= 1--       8.714                287.976                -74.529
 Raman2 Fr= 1--       0.111                  0.106                  1.250
 ROA2   Fr= 1--      16.929                 18.766                -66.139
 CID2   Fr= 1--     152.954                176.953                -52.927
 Raman3 Fr= 1--       0.221                  0.212                  2.499
 ROA3   Fr= 1--      62.327                 72.088               -262.981
 CID3   Fr= 1--     281.565                339.878               -105.225
 RC180  Fr= 1--      -0.938                  0.695                  0.417
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.00  -0.01     0.01   0.00  -0.02    -0.01  -0.00   0.01
     2   6    -0.00   0.00  -0.02     0.02   0.01   0.00     0.00  -0.01  -0.01
     3   7     0.02   0.00  -0.02    -0.02   0.04   0.07     0.01  -0.03  -0.04
     4  45    -0.00  -0.01  -0.00    -0.00   0.00  -0.01     0.00   0.00   0.00
     5   7    -0.02   0.00   0.02    -0.02  -0.04   0.07    -0.01  -0.03   0.03
     6   6     0.00   0.00   0.02     0.01  -0.01   0.00    -0.00  -0.01   0.01
     7   6     0.01  -0.00   0.01     0.01  -0.00  -0.02     0.01  -0.00  -0.01
     8   7     0.03   0.02  -0.06     0.02   0.03  -0.04     0.02   0.03  -0.04
     9   7    -0.03   0.02   0.05     0.02  -0.03  -0.04    -0.02   0.03   0.04
    10   7    -0.07   0.01  -0.02    -0.01  -0.01   0.01     0.06  -0.01   0.02
    11   6    -0.01   0.01   0.00     0.01   0.01   0.01     0.01  -0.02  -0.00
    12   1     0.00  -0.06   0.05    -0.02  -0.07   0.06    -0.01  -0.05   0.03
    13   1    -0.06   0.04   0.00    -0.09   0.03  -0.06    -0.06   0.04  -0.01
    14   1     0.01   0.02  -0.03     0.06   0.03  -0.05     0.06   0.04  -0.04
    15   1    -0.03   0.03   0.04    -0.07   0.05   0.00    -0.08   0.06   0.04
    16   1    -0.01   0.02   0.03     0.06  -0.04  -0.05    -0.05   0.04   0.04
    17   1     0.02   0.03  -0.04    -0.07  -0.05   0.00     0.08   0.06  -0.04
    18   1    -0.00  -0.06  -0.04    -0.01   0.08   0.06     0.01  -0.05  -0.03
    19   1     0.06   0.03  -0.00    -0.09  -0.03  -0.06     0.07   0.04   0.01
    20   1    -0.11   0.03  -0.28     0.08  -0.04   0.24    -0.08   0.04  -0.24
    21   1     0.28  -0.16   0.11    -0.21   0.15  -0.09     0.21  -0.16   0.09
    22   1     0.00  -0.01   0.06     0.05   0.13  -0.35    -0.00  -0.07   0.22
    23   1    -0.03   0.07  -0.03    -0.01  -0.38   0.14    -0.03   0.23  -0.08
    24   1     0.00  -0.02  -0.09     0.04  -0.13  -0.35    -0.00  -0.07  -0.21
    25   1     0.03   0.09   0.03     0.01   0.39   0.14     0.04   0.22   0.08
    26   1     0.12   0.03   0.30     0.08   0.03   0.22     0.08   0.03   0.24
    27   1    -0.30  -0.15  -0.11    -0.20  -0.14  -0.08    -0.21  -0.15  -0.09
    28   6     0.01   0.01  -0.00     0.01  -0.01   0.01    -0.01  -0.02   0.00
    29   7     0.07   0.01   0.02    -0.01   0.01   0.01    -0.06  -0.00  -0.02
    30   1     0.00  -0.14   0.32    -0.01   0.00  -0.01    -0.00   0.13  -0.29
    31   1     0.25   0.09  -0.19    -0.02   0.02   0.02    -0.23  -0.05   0.18
    32   1    -0.02  -0.09   0.02     0.04   0.05  -0.03     0.03   0.09  -0.02
    33   1     0.07   0.03   0.04    -0.05  -0.01  -0.03    -0.08  -0.03  -0.04
    34   1    -0.07   0.03  -0.04    -0.05   0.01  -0.02     0.08  -0.03   0.04
    35   1     0.02  -0.10  -0.02     0.04  -0.05  -0.03    -0.02   0.09   0.02
    36   1    -0.01  -0.14  -0.32    -0.01   0.01   0.01     0.01   0.13   0.29
    37   1    -0.24   0.09   0.19    -0.00  -0.02   0.00     0.23  -0.06  -0.18
                     28                     29                     30
                      A                      A                      A
 Frequencies --    742.5321               745.3809               767.8988
 Red. masses --      1.4607                 1.3937                 1.4360
 Frc consts  --      0.4745                 0.4562                 0.4989
 IR Inten    --      9.6791                 2.4171                16.6214
 RamAct Fr= 1--      0.0919                 1.0664                 0.6451
  Dep-P Fr= 1--      0.7492                 0.5023                 0.7499
  Dep-U Fr= 1--      0.8566                 0.6687                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0052                 0.0000
 Beta2  Fr= 1--      0.0131                 0.1189                 0.0921
 AlphaG Fr= 1--      0.0000                 0.0076                -0.0000
 Gamma2 Fr= 1--     -0.6403                 2.7220                 0.9866
 Delta2 Fr= 1--      0.0009                 0.1152                 0.0200
 Raman1 Fr= 1--       0.367                  4.266                  2.580
 ROA1   Fr= 1--     -61.438                265.001                 95.351
 CID1   Fr= 1--    -167.214                 62.123                 36.954
 Raman2 Fr= 1--       0.157                  1.426                  1.106
 ROA2   Fr= 1--     -15.373                 64.408                 23.517
 CID2   Fr= 1--     -97.688                 45.158                 21.269
 Raman3 Fr= 1--       0.315                  2.853                  2.211
 ROA3   Fr= 1--     -61.438                265.001                 95.351
 CID3   Fr= 1--    -195.203                 92.899                 43.117
 RC180  Fr= 1--       0.713                  0.337                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.02   0.01     0.01   0.01   0.03    -0.02  -0.02  -0.02
     2   6    -0.03   0.01   0.02    -0.03  -0.01   0.02     0.01  -0.01  -0.02
     3   7     0.01  -0.01  -0.03     0.00  -0.06  -0.07    -0.00   0.02   0.04
     4  45     0.01  -0.00   0.02     0.00   0.01   0.00     0.02  -0.00  -0.01
     5   7     0.01   0.01  -0.04    -0.00  -0.06   0.07    -0.00  -0.02   0.04
     6   6    -0.03  -0.01   0.02     0.02  -0.01  -0.02     0.01   0.01  -0.02
     7   6     0.00  -0.02   0.01    -0.01   0.01  -0.03    -0.02   0.02  -0.02
     8   7     0.01   0.02  -0.05    -0.03  -0.01   0.04    -0.04  -0.03   0.06
     9   7     0.00  -0.02  -0.05     0.03  -0.01  -0.04    -0.04   0.03   0.06
    10   7    -0.08   0.03  -0.01    -0.03   0.00  -0.01    -0.06  -0.00  -0.01
    11   6     0.04   0.02  -0.01    -0.01  -0.00  -0.00     0.03   0.02   0.02
    12   1     0.02   0.04  -0.06    -0.03  -0.01   0.05    -0.03   0.03   0.01
    13   1     0.06   0.01   0.12    -0.05  -0.01  -0.12    -0.00  -0.03  -0.09
    14   1     0.04   0.05  -0.07     0.05  -0.01   0.01    -0.01  -0.03   0.06
    15   1    -0.05   0.07   0.12    -0.04  -0.01  -0.10     0.02  -0.05  -0.12
    16   1     0.04  -0.05  -0.07    -0.05  -0.00  -0.01    -0.01   0.03   0.06
    17   1    -0.05  -0.07   0.11     0.03  -0.01   0.10     0.02   0.05  -0.12
    18   1     0.02  -0.04  -0.06     0.03  -0.02  -0.05    -0.03  -0.03   0.01
    19   1     0.05  -0.01   0.11     0.05  -0.01   0.12     0.00   0.03  -0.10
    20   1     0.09  -0.00   0.17     0.09  -0.00   0.17    -0.12   0.04  -0.28
    21   1    -0.17   0.09  -0.08    -0.21   0.08  -0.08     0.29  -0.16   0.12
    22   1    -0.05  -0.05   0.10    -0.04  -0.13   0.34     0.04   0.07  -0.15
    23   1     0.03   0.12  -0.05     0.03   0.41  -0.15    -0.03  -0.18   0.08
    24   1    -0.05   0.06   0.11     0.04  -0.13  -0.34     0.04  -0.07  -0.14
    25   1     0.02  -0.14  -0.06    -0.01   0.40   0.15    -0.02   0.18   0.07
    26   1     0.09  -0.00   0.17    -0.09  -0.00  -0.17    -0.12  -0.04  -0.28
    27   1    -0.18  -0.08  -0.09     0.21   0.08   0.08     0.29   0.15   0.12
    28   6     0.04  -0.02  -0.01     0.01  -0.01   0.00     0.02  -0.02   0.02
    29   7    -0.08  -0.03  -0.01     0.03  -0.00   0.00    -0.06   0.01  -0.01
    30   1    -0.02  -0.22   0.35     0.00  -0.05   0.13    -0.02  -0.15   0.23
    31   1     0.26   0.11  -0.20     0.09   0.02  -0.08     0.18   0.10  -0.14
    32   1     0.11   0.00  -0.09    -0.01  -0.05   0.00     0.12   0.05  -0.09
    33   1    -0.03   0.04   0.00     0.02   0.01   0.02    -0.08   0.00  -0.02
    34   1    -0.03  -0.04   0.00    -0.03   0.01  -0.02    -0.08  -0.00  -0.02
    35   1     0.11  -0.01  -0.09     0.01  -0.05  -0.01     0.12  -0.06  -0.09
    36   1    -0.01   0.22   0.35    -0.00  -0.04  -0.12    -0.01   0.15   0.23
    37   1     0.25  -0.12  -0.20    -0.08   0.01   0.07     0.18  -0.11  -0.14
                     31                     32                     33
                      A                      A                      A
 Frequencies --    866.2363               866.3049               867.6155
 Red. masses --      3.2179                 3.1894                 3.1366
 Frc consts  --      1.4226                 1.4103                 1.3911
 IR Inten    --     10.3393                10.1638                 0.0085
 RamAct Fr= 1--      1.0440                 0.8188                 8.8818
  Dep-P Fr= 1--      0.7419                 0.7432                 0.0610
  Dep-U Fr= 1--      0.8518                 0.8527                 0.1150
 Alpha2 Fr= 1--      0.0001                 0.0001                 0.1709
 Beta2  Fr= 1--      0.1482                 0.1164                 0.1703
 AlphaG Fr= 1--     -0.0005                 0.0012                -0.0537
 Gamma2 Fr= 1--      0.5889                 0.9529                -2.5332
 Delta2 Fr= 1--      0.7257                 0.9024                -2.4765
 Raman1 Fr= 1--       4.176                  3.275                 35.527
 ROA1   Fr= 1--      79.759                120.358               -322.433
 CID1   Fr= 1--      19.099                 36.749                 -9.076
 Raman2 Fr= 1--       1.779                  1.396                  2.043
 ROA2   Fr= 1--       8.328                 15.652                -40.985
 CID2   Fr= 1--       4.682                 11.209                -20.057
 Raman3 Fr= 1--       3.557                  2.793                  4.087
 ROA3   Fr= 1--      79.759                120.358               -322.433
 CID3   Fr= 1--      22.421                 43.097                -78.896
 RC180  Fr= 1--       0.704                  0.705                 -0.770
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.08   0.08   0.08     0.08   0.07   0.09     0.10   0.05   0.10
     2   6     0.09   0.05  -0.09     0.10   0.05  -0.09     0.12   0.03  -0.08
     3   7    -0.08  -0.01  -0.03    -0.08  -0.01  -0.04    -0.12   0.00  -0.05
     4  45     0.00  -0.00  -0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
     5   7    -0.12   0.01  -0.05     0.03  -0.00   0.02     0.13  -0.00   0.05
     6   6     0.14  -0.07  -0.13    -0.03   0.02   0.03    -0.12   0.02   0.06
     7   6     0.11  -0.11   0.12    -0.03   0.02  -0.03    -0.10   0.04  -0.10
     8   7    -0.07   0.13   0.06     0.01  -0.03  -0.01     0.04  -0.04  -0.02
     9   7    -0.06  -0.09   0.05    -0.05  -0.09   0.04    -0.05  -0.06   0.03
    10   7    -0.00   0.01   0.00     0.03  -0.12  -0.08    -0.02   0.08   0.04
    11   6    -0.04  -0.04   0.03     0.13   0.15  -0.01    -0.09  -0.10   0.02
    12   1     0.03  -0.06   0.34    -0.01   0.02  -0.09    -0.01   0.10  -0.38
    13   1    -0.03  -0.05   0.08     0.01   0.01  -0.02     0.10   0.01   0.04
    14   1     0.10   0.01  -0.42    -0.02   0.00   0.09    -0.04   0.02   0.17
    15   1     0.01   0.08  -0.03    -0.00  -0.02   0.01    -0.04  -0.01   0.10
    16   1     0.07  -0.01  -0.30     0.07  -0.01  -0.30     0.06   0.01  -0.23
    17   1    -0.00  -0.06  -0.02     0.00  -0.06  -0.02     0.03  -0.03  -0.08
    18   1     0.03   0.04   0.22     0.03   0.04   0.24     0.02   0.09   0.36
    19   1    -0.01   0.04   0.06    -0.02   0.03   0.06    -0.08   0.02  -0.01
    20   1    -0.05  -0.07  -0.02    -0.04  -0.07   0.00    -0.07  -0.06  -0.01
    21   1    -0.08  -0.18   0.05    -0.10  -0.17   0.03    -0.11  -0.15   0.02
    22   1    -0.08  -0.01   0.01    -0.09  -0.02   0.03    -0.10   0.01  -0.03
    23   1    -0.18  -0.01  -0.03    -0.19   0.02  -0.04    -0.20  -0.01  -0.04
    24   1    -0.12   0.02   0.02     0.03  -0.01  -0.02     0.09   0.01   0.03
    25   1    -0.26   0.01  -0.05     0.06   0.02   0.02     0.19  -0.01   0.05
    26   1    -0.06   0.10  -0.02     0.01  -0.02  -0.01     0.06  -0.06   0.01
    27   1    -0.12   0.26   0.06     0.04  -0.05  -0.00     0.11  -0.13  -0.01
    28   6     0.03  -0.04   0.02    -0.12   0.16   0.03     0.08  -0.10  -0.01
    29   7     0.01   0.05  -0.04    -0.03  -0.11   0.07     0.03   0.08  -0.05
    30   1     0.01   0.06   0.02    -0.00  -0.25  -0.14     0.01   0.17   0.11
    31   1     0.01   0.03  -0.00    -0.02  -0.11  -0.06     0.03   0.05   0.01
    32   1     0.02   0.04  -0.03     0.08  -0.02   0.04    -0.05  -0.00  -0.03
    33   1    -0.17  -0.02   0.02     0.37   0.07  -0.08    -0.25  -0.04   0.06
    34   1     0.04  -0.02  -0.02    -0.41   0.09   0.08     0.22  -0.04  -0.06
    35   1     0.05  -0.03  -0.01    -0.06  -0.04  -0.05     0.06  -0.02   0.02
    36   1     0.01   0.07  -0.05    -0.00  -0.25   0.13     0.00   0.16  -0.13
    37   1     0.01   0.03  -0.03     0.02  -0.11   0.04    -0.03   0.05  -0.01
                     34                     35                     36
                      A                      A                      A
 Frequencies --    868.9118               872.6305               874.0421
 Red. masses --      2.5441                 2.4747                 2.5530
 Frc consts  --      1.1317                 1.1103                 1.1491
 IR Inten    --      2.0569                 0.0609                 3.0438
 RamAct Fr= 1--      2.1431                 3.2717                 0.4995
  Dep-P Fr= 1--      0.7289                 0.6296                 0.7467
  Dep-U Fr= 1--      0.8432                 0.7727                 0.8550
 Alpha2 Fr= 1--      0.0008                 0.0072                 0.0000
 Beta2  Fr= 1--      0.3012                 0.4213                 0.0712
 AlphaG Fr= 1--     -0.0002                 0.0019                 0.0000
 Gamma2 Fr= 1--      0.4610                -1.1796                 0.7544
 Delta2 Fr= 1--     -0.3051                -0.6687                 0.1203
 Raman1 Fr= 1--       8.573                 13.087                  1.998
 ROA1   Fr= 1--      34.491               -134.643                 76.272
 CID1   Fr= 1--       4.023                -10.289                 38.175
 Raman2 Fr= 1--       3.614                  5.056                  0.854
 ROA2   Fr= 1--      13.505                -22.961                 17.144
 CID2   Fr= 1--       3.737                 -4.541                 20.071
 Raman3 Fr= 1--       7.229                 10.112                  1.708
 ROA3   Fr= 1--      34.491               -134.643                 76.272
 CID3   Fr= 1--       4.772                -13.315                 44.648
 RC180  Fr= 1--       0.686                  0.545                  0.710
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.06   0.06  -0.07     0.03  -0.10   0.04     0.02  -0.06   0.03
     2   6    -0.07   0.06  -0.03     0.04  -0.09   0.07     0.02  -0.05   0.04
     3   7     0.12  -0.02   0.05    -0.10   0.02  -0.04    -0.06   0.00  -0.05
     4  45    -0.01  -0.00  -0.00     0.00  -0.01  -0.00    -0.00  -0.00   0.01
     5   7     0.12   0.01   0.05     0.09   0.02   0.05    -0.04   0.00  -0.04
     6   6    -0.06  -0.07  -0.04    -0.04  -0.09  -0.07     0.02   0.04   0.03
     7   6    -0.05  -0.07  -0.06    -0.03  -0.10  -0.04     0.01   0.04   0.03
     8   7    -0.03   0.09   0.05    -0.04   0.13   0.05     0.03  -0.04  -0.04
     9   7    -0.03  -0.07   0.04     0.05   0.12  -0.05     0.04   0.07  -0.05
    10   7     0.03  -0.08  -0.06    -0.01  -0.00  -0.00     0.02  -0.11  -0.11
    11   6    -0.01   0.01   0.08     0.02   0.03  -0.02    -0.02   0.01   0.14
    12   1     0.03   0.12  -0.33     0.03   0.09  -0.25    -0.01  -0.04   0.11
    13   1     0.17  -0.05   0.19     0.14  -0.03   0.22    -0.06   0.03  -0.05
    14   1     0.07   0.06  -0.25     0.12   0.08  -0.38    -0.05  -0.03   0.14
    15   1    -0.09   0.11   0.19    -0.12   0.15   0.21     0.07  -0.05  -0.05
    16   1     0.05  -0.05  -0.18    -0.11   0.08   0.37    -0.07   0.04   0.21
    17   1    -0.09  -0.09   0.18     0.13   0.14  -0.22     0.09   0.08  -0.09
    18   1     0.02  -0.12  -0.34    -0.03   0.09   0.26    -0.01   0.06   0.16
    19   1     0.16   0.04   0.17    -0.14  -0.02  -0.23    -0.09  -0.03  -0.09
    20   1     0.04  -0.01   0.02    -0.03   0.08  -0.09    -0.00   0.03   0.02
    21   1     0.07  -0.03   0.06     0.01   0.07  -0.05    -0.06   0.09  -0.07
    22   1     0.04  -0.05   0.06     0.01   0.07  -0.07    -0.00   0.01   0.03
    23   1     0.08  -0.04   0.06    -0.01   0.04  -0.05    -0.03   0.11  -0.07
    24   1     0.04   0.06   0.06    -0.01   0.07   0.06    -0.00  -0.00   0.04
    25   1     0.06   0.05   0.06     0.01   0.06   0.06    -0.03  -0.09  -0.06
    26   1     0.04   0.03   0.03     0.03   0.08   0.08     0.00  -0.01   0.03
    27   1     0.06   0.06   0.07     0.00   0.08   0.06    -0.07  -0.07  -0.06
    28   6    -0.02   0.01   0.08    -0.01   0.03  -0.01    -0.02  -0.01   0.14
    29   7     0.04   0.07  -0.05    -0.00  -0.03   0.03     0.03   0.11  -0.11
    30   1     0.03   0.03  -0.14    -0.00  -0.04   0.02     0.04  -0.02  -0.10
    31   1    -0.02   0.00  -0.02     0.01  -0.03  -0.02     0.04   0.00  -0.11
    32   1     0.11   0.13  -0.06    -0.02  -0.06   0.03     0.24   0.19  -0.15
    33   1    -0.22  -0.04  -0.01     0.13   0.03  -0.00    -0.41  -0.03   0.01
    34   1    -0.24   0.05  -0.01    -0.03   0.02   0.00    -0.42   0.05   0.01
    35   1     0.10  -0.13  -0.07    -0.03  -0.01   0.01     0.23  -0.21  -0.16
    36   1     0.03  -0.05  -0.13    -0.01  -0.04   0.01     0.04   0.01  -0.10
    37   1    -0.02  -0.01  -0.01    -0.02  -0.03   0.04     0.04  -0.01  -0.11
                     37                     38                     39
                      A                      A                      A
 Frequencies --    981.7040               983.0581               983.4969
 Red. masses --      2.1966                 2.2119                 2.2060
 Frc consts  --      1.2473                 1.2594                 1.2572
 IR Inten    --      6.4901                 1.4707                 1.9450
 RamAct Fr= 1--      1.4526                 3.2802                 5.4798
  Dep-P Fr= 1--      0.7500                 0.7499                 0.7477
  Dep-U Fr= 1--      0.8571                 0.8571                 0.8557
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0002
 Beta2  Fr= 1--      0.2075                 0.4686                 0.7815
 AlphaG Fr= 1--      0.0000                -0.0000                 0.0015
 Gamma2 Fr= 1--      0.3410                -0.1360                 0.3773
 Delta2 Fr= 1--     -0.6260                 0.0202                 1.0848
 Raman1 Fr= 1--       5.810                 13.121                 21.919
 ROA1   Fr= 1--      12.705                -12.413                 70.933
 CID1   Fr= 1--       2.187                 -0.946                  3.236
 Raman2 Fr= 1--       2.490                  5.623                  9.378
 ROA2   Fr= 1--      13.193                 -3.426                  0.377
 CID2   Fr= 1--       5.298                 -0.609                  0.040
 Raman3 Fr= 1--       4.980                 11.246                 18.755
 ROA3   Fr= 1--      12.705                -12.413                 70.933
 CID3   Fr= 1--       2.551                 -1.104                  3.782
 RC180  Fr= 1--       0.714                  0.714                  0.711
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.06  -0.04  -0.00    -0.11  -0.07  -0.00     0.12   0.08   0.01
     2   6     0.06   0.03   0.00     0.12   0.06  -0.00    -0.13  -0.07  -0.01
     3   7    -0.03  -0.01  -0.00    -0.06  -0.02  -0.00     0.07   0.02   0.01
     4  45     0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00  -0.00
     5   7    -0.03   0.01  -0.00    -0.06   0.02  -0.00    -0.07   0.02  -0.01
     6   6     0.06  -0.03   0.00     0.11  -0.06  -0.00     0.13  -0.08   0.01
     7   6    -0.06   0.04  -0.00    -0.11   0.07   0.00    -0.12   0.08  -0.01
     8   7     0.02  -0.02   0.00     0.04  -0.04  -0.00     0.05  -0.05  -0.00
     9   7     0.02   0.02   0.00     0.04   0.04  -0.00    -0.05  -0.05   0.00
    10   7    -0.00  -0.08  -0.02     0.00   0.04   0.01    -0.00  -0.00   0.00
    11   6     0.01   0.18   0.00    -0.00  -0.10  -0.00    -0.01   0.01  -0.01
    12   1    -0.04   0.14  -0.05    -0.09   0.27  -0.09    -0.10   0.28  -0.09
    13   1     0.06   0.02   0.08     0.12   0.04   0.17     0.10   0.07   0.18
    14   1     0.14   0.02  -0.04     0.26   0.03  -0.08     0.33   0.05  -0.10
    15   1    -0.00   0.06   0.08     0.00   0.12   0.16    -0.02   0.15   0.19
    16   1     0.15  -0.03  -0.04     0.27  -0.05  -0.09    -0.32   0.06   0.10
    17   1    -0.01  -0.06   0.08    -0.01  -0.12   0.16     0.03   0.14  -0.19
    18   1    -0.05  -0.14  -0.05    -0.10  -0.27  -0.09     0.11   0.27   0.08
    19   1     0.06  -0.02   0.08     0.11  -0.05   0.17    -0.09   0.07  -0.17
    20   1     0.06   0.05   0.01     0.11   0.08   0.03    -0.09  -0.07  -0.04
    21   1     0.07   0.06   0.01     0.14   0.11   0.01    -0.16  -0.15  -0.01
    22   1    -0.07  -0.02   0.00    -0.11  -0.04   0.03     0.16   0.06  -0.04
    23   1    -0.09  -0.04   0.01    -0.17  -0.05   0.01     0.16   0.04  -0.00
    24   1    -0.06   0.02   0.00    -0.10   0.04   0.02    -0.16   0.07   0.04
    25   1    -0.08   0.04   0.01    -0.17   0.06   0.01    -0.17   0.05   0.00
    26   1     0.05  -0.05   0.01     0.10  -0.09   0.02     0.09  -0.08   0.04
    27   1     0.06  -0.06   0.01     0.13  -0.11   0.01     0.15  -0.16   0.01
    28   6    -0.00  -0.18   0.00    -0.00   0.09  -0.00     0.01   0.00   0.01
    29   7    -0.00   0.08  -0.02     0.00  -0.04   0.01     0.00  -0.00  -0.00
    30   1    -0.04  -0.26  -0.05     0.02   0.13   0.01     0.01   0.04   0.01
    31   1    -0.05  -0.15  -0.01     0.02   0.10   0.01    -0.00  -0.06  -0.00
    32   1    -0.18  -0.09   0.22     0.09   0.05  -0.11    -0.02  -0.06   0.00
    33   1     0.21   0.29   0.19    -0.10  -0.16  -0.11     0.04   0.02   0.02
    34   1     0.19  -0.30   0.19    -0.09   0.16  -0.11    -0.04   0.02  -0.02
    35   1    -0.18   0.09   0.22     0.08  -0.04  -0.11     0.02  -0.06  -0.00
    36   1    -0.03   0.26  -0.05     0.01  -0.14   0.01    -0.01   0.04  -0.01
    37   1    -0.04   0.15  -0.01     0.02  -0.09   0.01    -0.00  -0.06   0.00
                     40                     41                     42
                      A                      A                      A
 Frequencies --    998.5077              1000.8016              1008.6616
 Red. masses --      1.2447                 1.2587                 1.2682
 Frc consts  --      0.7312                 0.7428                 0.7602
 IR Inten    --     11.0218                 1.4117                 9.7873
 RamAct Fr= 1--      0.1849                 0.9079                 0.4974
  Dep-P Fr= 1--      0.7435                 0.0239                 0.3169
  Dep-U Fr= 1--      0.8529                 0.0467                 0.4812
 Alpha2 Fr= 1--      0.0000                 0.0191                 0.0048
 Beta2  Fr= 1--      0.0263                 0.0071                 0.0399
 AlphaG Fr= 1--     -0.0000                -0.0105                -0.1042
 Gamma2 Fr= 1--      1.0938                 0.4902                -0.9515
 Delta2 Fr= 1--      0.2251                 0.0210                 0.1907
 Raman1 Fr= 1--       0.740                  3.632                  1.990
 ROA1   Fr= 1--     112.207                 47.727                -85.240
 CID1   Fr= 1--     151.718                 13.142                -42.839
 Raman2 Fr= 1--       0.315                  0.085                  0.479
 ROA2   Fr= 1--      24.451                 11.596                -24.361
 CID2   Fr= 1--      77.528                136.711                -50.881
 Raman3 Fr= 1--       0.631                  0.170                  0.958
 ROA3   Fr= 1--     112.207                 47.727                -85.240
 CID3   Fr= 1--     177.891                281.332                -89.017
 RC180  Fr= 1--       0.706                 -0.907                 -0.038
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.04   0.05   0.03     0.04  -0.02  -0.01    -0.04   0.04   0.03
     2   6     0.01  -0.06  -0.03    -0.02   0.02   0.02     0.01  -0.05  -0.03
     3   7    -0.01   0.01  -0.00     0.01  -0.01  -0.01    -0.01   0.01   0.00
     4  45    -0.00   0.00   0.00     0.00  -0.00  -0.00     0.00  -0.00   0.00
     5   7    -0.01  -0.01  -0.00    -0.00  -0.01   0.01     0.01   0.01  -0.00
     6   6     0.01   0.06  -0.03     0.02   0.02  -0.02    -0.02  -0.05   0.03
     7   6    -0.05  -0.05   0.03    -0.04  -0.01   0.01     0.04   0.04  -0.03
     8   7     0.01   0.02  -0.00     0.01   0.00   0.01    -0.01  -0.02   0.00
     9   7     0.01  -0.01  -0.00    -0.01   0.00  -0.01     0.00  -0.02  -0.00
    10   7    -0.00   0.00   0.00    -0.01   0.00  -0.02    -0.01  -0.00  -0.01
    11   6     0.00   0.00  -0.00     0.07  -0.02   0.05     0.03  -0.01   0.04
    12   1     0.00   0.16  -0.13    -0.01   0.11  -0.09     0.00  -0.15   0.10
    13   1     0.21  -0.15   0.10     0.11  -0.07   0.06    -0.17   0.13  -0.09
    14   1    -0.17  -0.08   0.13    -0.04  -0.03   0.04     0.14   0.06  -0.10
    15   1     0.24  -0.13  -0.09     0.10  -0.04  -0.02    -0.19   0.10   0.08
    16   1    -0.16   0.08   0.12     0.04  -0.03  -0.05    -0.13   0.07   0.10
    17   1     0.23   0.11  -0.08    -0.12  -0.04   0.03     0.20   0.09  -0.08
    18   1    -0.00  -0.16  -0.12     0.01   0.12   0.10    -0.01  -0.16  -0.11
    19   1     0.20   0.13   0.10    -0.13  -0.07  -0.07     0.18   0.12   0.09
    20   1     0.23   0.14   0.03    -0.13  -0.08  -0.01     0.22   0.13   0.04
    21   1    -0.14  -0.12  -0.03     0.07   0.08   0.01    -0.12  -0.11  -0.02
    22   1     0.26   0.13  -0.02    -0.12  -0.06   0.01     0.21   0.11  -0.03
    23   1    -0.20  -0.03   0.01     0.13   0.05  -0.02    -0.17  -0.06   0.02
    24   1     0.26  -0.14  -0.02     0.10  -0.06  -0.01    -0.21   0.12   0.03
    25   1    -0.20   0.05   0.02    -0.11   0.05   0.02     0.16  -0.07  -0.02
    26   1     0.24  -0.16   0.03     0.11  -0.08   0.01    -0.21   0.14  -0.04
    27   1    -0.14   0.14  -0.03    -0.05   0.07  -0.01     0.12  -0.11   0.02
    28   6    -0.00  -0.00  -0.00    -0.07  -0.02  -0.05    -0.03  -0.01  -0.04
    29   7    -0.00  -0.00   0.00     0.01   0.00   0.02     0.01  -0.00   0.01
    30   1    -0.00  -0.01  -0.00    -0.05  -0.24  -0.04    -0.03  -0.13  -0.01
    31   1    -0.01   0.01   0.01     0.04   0.35   0.00     0.04   0.20  -0.01
    32   1    -0.00   0.00   0.00     0.12   0.30  -0.02     0.07   0.19  -0.00
    33   1    -0.00  -0.00  -0.01    -0.20  -0.11  -0.11    -0.14  -0.06  -0.06
    34   1     0.01  -0.01   0.00     0.20  -0.12   0.12     0.13  -0.07   0.06
    35   1    -0.01   0.02   0.01    -0.11   0.30   0.03    -0.06   0.20   0.00
    36   1    -0.00  -0.01   0.00     0.04  -0.24   0.04     0.02  -0.14   0.01
    37   1    -0.01   0.01   0.01    -0.02   0.35  -0.00    -0.03   0.20   0.01
                     43                     44                     45
                      A                      A                      A
 Frequencies --   1048.2131              1048.8355              1050.3416
 Red. masses --      3.1942                 3.1878                 3.1363
 Frc consts  --      2.0678                 2.0661                 2.0386
 IR Inten    --     67.9328                59.4079                 9.0356
 RamAct Fr= 1--      0.4580                 1.3506                 1.5426
  Dep-P Fr= 1--      0.7460                 0.6528                 0.2810
  Dep-U Fr= 1--      0.8545                 0.7900                 0.4387
 Alpha2 Fr= 1--      0.0000                 0.0024                 0.0167
 Beta2  Fr= 1--      0.0652                 0.1778                 0.1128
 AlphaG Fr= 1--     -0.0002                 0.0201                -0.0448
 Gamma2 Fr= 1--      1.7716                -1.3758                 1.2096
 Delta2 Fr= 1--      0.8399                -1.1335                 0.9978
 Raman1 Fr= 1--       1.832                  5.402                  6.170
 ROA1   Fr= 1--     196.948               -168.349                148.046
 CID1   Fr= 1--     107.506                -31.162                 23.993
 Raman2 Fr= 1--       0.783                  2.134                  1.353
 ROA2   Fr= 1--      35.798                -23.951                 21.047
 CID2   Fr= 1--      45.736                -11.224                 15.551
 Raman3 Fr= 1--       1.565                  4.268                  2.707
 ROA3   Fr= 1--     196.948               -168.349                148.046
 CID3   Fr= 1--     125.810                -39.447                 54.692
 RC180  Fr= 1--       0.709                  0.580                 -0.123
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03   0.10  -0.14    -0.01  -0.03   0.05     0.03   0.11  -0.15
     2   6     0.09  -0.03   0.15    -0.02   0.01  -0.05     0.10  -0.04   0.16
     3   7    -0.10  -0.01  -0.01     0.03   0.00   0.01    -0.11  -0.00  -0.01
     4  45     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00   0.00
     5   7    -0.12   0.01  -0.01    -0.02   0.00  -0.01     0.10  -0.01   0.01
     6   6     0.11   0.03   0.17     0.02   0.00   0.04    -0.09  -0.03  -0.14
     7   6     0.03  -0.11  -0.16     0.01  -0.02  -0.04    -0.02   0.10   0.14
     8   7    -0.06   0.10   0.01    -0.01   0.02   0.00     0.05  -0.08  -0.01
     9   7    -0.06  -0.08   0.01     0.02   0.03  -0.00    -0.06  -0.09   0.01
    10   7    -0.00   0.00   0.00     0.01   0.13   0.07     0.00   0.03   0.02
    11   6     0.00  -0.00  -0.00     0.16  -0.10  -0.17     0.04  -0.03  -0.05
    12   1     0.08  -0.11  -0.32     0.02  -0.05  -0.06    -0.07   0.11   0.29
    13   1     0.09  -0.17  -0.20    -0.00  -0.02  -0.05    -0.07   0.14   0.16
    14   1     0.14  -0.01   0.33     0.03   0.00   0.05    -0.11   0.01  -0.29
    15   1     0.17   0.00   0.20     0.03   0.01   0.05    -0.16   0.00  -0.17
    16   1     0.12   0.01   0.29    -0.04   0.00  -0.08     0.12   0.01   0.33
    17   1     0.15  -0.01   0.17    -0.04   0.01  -0.07     0.18  -0.00   0.20
    18   1     0.07   0.09  -0.28    -0.03  -0.05   0.08     0.09   0.12  -0.33
    19   1     0.08   0.14  -0.18    -0.00  -0.03   0.06     0.09   0.15  -0.18
    20   1    -0.01  -0.05   0.04     0.03   0.03  -0.01    -0.01  -0.07   0.03
    21   1     0.12   0.03   0.04    -0.06  -0.02  -0.02     0.11   0.03   0.04
    22   1    -0.06   0.02  -0.04     0.03   0.00   0.00    -0.04   0.03  -0.04
    23   1     0.11   0.09  -0.04    -0.03  -0.04   0.02     0.08   0.08  -0.04
    24   1    -0.07  -0.02  -0.04    -0.02   0.01  -0.00     0.03   0.03   0.03
    25   1     0.12  -0.11  -0.05     0.02  -0.03  -0.01    -0.06   0.07   0.03
    26   1    -0.00   0.06   0.04    -0.03   0.03   0.01     0.01  -0.06  -0.03
    27   1     0.14  -0.04   0.05     0.05  -0.02   0.01    -0.10   0.03  -0.04
    28   6    -0.00  -0.00   0.00    -0.16  -0.10   0.17    -0.04  -0.03   0.05
    29   7    -0.00   0.00  -0.00    -0.01   0.13  -0.07     0.00   0.03  -0.02
    30   1    -0.00  -0.01   0.00    -0.04  -0.18   0.06    -0.01  -0.03   0.02
    31   1     0.00   0.00  -0.00    -0.02   0.05   0.08    -0.00   0.02   0.02
    32   1     0.01  -0.01  -0.01     0.19  -0.20  -0.20     0.05  -0.06  -0.06
    33   1     0.01  -0.01  -0.01     0.37  -0.17  -0.21     0.11  -0.05  -0.06
    34   1    -0.01  -0.00   0.00    -0.38  -0.15   0.21    -0.11  -0.04   0.06
    35   1    -0.00  -0.00   0.00    -0.20  -0.20   0.20    -0.06  -0.06   0.06
    36   1    -0.00  -0.00  -0.00     0.03  -0.18  -0.06     0.01  -0.03  -0.02
    37   1     0.00  -0.00  -0.01     0.02   0.05  -0.08     0.00   0.02  -0.02
                     46                     47                     48
                      A                      A                      A
 Frequencies --   1111.6532              1118.8637              1119.3578
 Red. masses --      1.0209                 1.0281                 1.0262
 Frc consts  --      0.7433                 0.7583                 0.7576
 IR Inten    --      0.4538                 0.5040                 0.1639
 RamAct Fr= 1--      0.4079                 0.5342                 0.8011
  Dep-P Fr= 1--      0.7500                 0.7473                 0.7439
  Dep-U Fr= 1--      0.8571                 0.8554                 0.8531
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0001
 Beta2  Fr= 1--      0.0583                 0.0762                 0.1139
 AlphaG Fr= 1--     -0.0000                -0.0000                -0.0002
 Gamma2 Fr= 1--     -0.1836                 0.2393                -0.6556
 Delta2 Fr= 1--     -0.0591                -0.0095                -0.3099
 Raman1 Fr= 1--       1.632                  2.137                  3.204
 ROA1   Fr= 1--     -19.519                 22.665                -72.849
 CID1   Fr= 1--     -11.964                 10.606                -22.734
 Raman2 Fr= 1--       0.699                  0.914                  1.367
 ROA2   Fr= 1--      -3.934                  5.819                -13.254
 CID2   Fr= 1--      -5.626                  6.367                 -9.697
 Raman3 Fr= 1--       1.398                  1.828                  2.734
 ROA3   Fr= 1--     -19.519                 22.665                -72.849
 CID3   Fr= 1--     -13.958                 12.400                -26.648
 RC180  Fr= 1--       0.714                  0.711                  0.706
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.00   0.00     0.00   0.00   0.01     0.00   0.00   0.00
     2   6    -0.00  -0.00   0.00    -0.01  -0.01   0.00    -0.00  -0.00   0.00
     3   7    -0.01  -0.00  -0.01     0.00   0.01  -0.01    -0.01  -0.00  -0.01
     4  45     0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00  -0.00  -0.00
     5   7    -0.01   0.00  -0.01     0.01  -0.00   0.00     0.01   0.00   0.01
     6   6    -0.00   0.00   0.00    -0.00   0.00  -0.00     0.01  -0.01  -0.00
     7   6     0.00  -0.00   0.00     0.00  -0.00   0.00    -0.01   0.00  -0.01
     8   7     0.00  -0.01  -0.01    -0.01   0.01   0.00    -0.00   0.01   0.01
     9   7     0.00   0.01  -0.01    -0.01  -0.00  -0.01     0.01   0.01  -0.01
    10   7     0.00  -0.01  -0.00     0.01  -0.01  -0.01    -0.00   0.00   0.00
    11   6    -0.00  -0.00  -0.00    -0.00  -0.01   0.00     0.00   0.00  -0.00
    12   1     0.04  -0.10  -0.07    -0.04   0.11   0.10    -0.03   0.07   0.05
    13   1    -0.08   0.15   0.17     0.08  -0.16  -0.18     0.08  -0.13  -0.14
    14   1    -0.10  -0.01  -0.09     0.10   0.01   0.10     0.09   0.01   0.06
    15   1     0.17  -0.00   0.18    -0.17  -0.00  -0.18    -0.15   0.01  -0.14
    16   1    -0.10   0.02  -0.08     0.01  -0.00   0.02    -0.14   0.02  -0.12
    17   1     0.16  -0.00   0.17    -0.02   0.01  -0.03     0.22  -0.00   0.24
    18   1     0.04   0.10  -0.07    -0.01  -0.03   0.04     0.05   0.13  -0.11
    19   1    -0.09  -0.14   0.16     0.01   0.03  -0.03    -0.13  -0.20   0.23
    20   1    -0.22  -0.16  -0.00     0.05   0.03   0.02    -0.31  -0.21  -0.01
    21   1     0.09   0.14   0.01     0.02   0.01  -0.00     0.11   0.17   0.00
    22   1     0.25   0.10   0.01    -0.05  -0.02   0.01     0.35   0.15   0.00
    23   1    -0.15   0.01  -0.01    -0.01  -0.02   0.00    -0.21  -0.02   0.00
    24   1     0.25  -0.12   0.01    -0.26   0.13   0.01    -0.21   0.10  -0.01
    25   1    -0.16  -0.00  -0.00     0.14  -0.01  -0.00     0.16  -0.04  -0.00
    26   1    -0.23   0.17  -0.00     0.24  -0.18   0.02     0.18  -0.14  -0.01
    27   1     0.09  -0.14   0.00    -0.05   0.11  -0.00    -0.09   0.13  -0.00
    28   6    -0.00   0.00  -0.00    -0.00   0.01   0.00    -0.00  -0.00  -0.00
    29   7     0.00   0.01  -0.00     0.01   0.01  -0.01    -0.00  -0.00   0.00
    30   1    -0.03  -0.12  -0.05    -0.03  -0.16  -0.09     0.02   0.09   0.04
    31   1     0.02   0.26   0.02     0.01   0.36   0.04    -0.00  -0.13  -0.01
    32   1    -0.12   0.14   0.12    -0.17   0.19   0.18     0.07  -0.08  -0.07
    33   1     0.06  -0.08  -0.08     0.06  -0.12  -0.13    -0.02   0.03   0.03
    34   1     0.06   0.07  -0.08     0.06   0.11  -0.12    -0.03  -0.05   0.06
    35   1    -0.12  -0.13   0.12    -0.18  -0.19   0.18     0.06   0.07  -0.07
    36   1    -0.02   0.12  -0.05    -0.03   0.18  -0.09     0.01  -0.05   0.03
    37   1     0.01  -0.26   0.02    -0.00  -0.35   0.03     0.00   0.15  -0.01
                     49                     50                     51
                      A                      A                      A
 Frequencies --   1170.6366              1172.2226              1189.7807
 Red. masses --      1.0742                 1.0712                 1.0612
 Frc consts  --      0.8674                 0.8672                 0.8851
 IR Inten    --     73.7737                68.4862                 0.8745
 RamAct Fr= 1--      9.4307                 8.9273                 7.9377
  Dep-P Fr= 1--      0.7394                 0.7500                 0.2914
  Dep-U Fr= 1--      0.8502                 0.8571                 0.4513
 Alpha2 Fr= 1--      0.0017                 0.0000                 0.0835
 Beta2  Fr= 1--      1.3363                 1.2753                 0.5971
 AlphaG Fr= 1--      0.0280                 0.0000                -0.0240
 Gamma2 Fr= 1--     -2.6534                 2.0059                -0.7393
 Delta2 Fr= 1--      3.3012                 5.3099                -5.0561
 Raman1 Fr= 1--      37.723                 35.709                 31.751
 ROA1   Fr= 1--    -149.090                362.483               -232.765
 CID1   Fr= 1--      -3.952                 10.151                 -7.331
 Raman2 Fr= 1--      16.035                 15.304                  7.165
 ROA2   Fr= 1--     -90.092                  5.663                 22.706
 CID2   Fr= 1--      -5.618                  0.370                  3.169
 Raman3 Fr= 1--      32.070                 30.608                 14.330
 ROA3   Fr= 1--    -149.090                362.483               -232.765
 CID3   Fr= 1--      -4.649                 11.843                -16.244
 RC180  Fr= 1--       0.700                  0.714                 -0.097
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00   0.00  -0.01
     2   6    -0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00   0.01
     3   7    -0.01  -0.00   0.01    -0.03  -0.01   0.02    -0.03  -0.00   0.01
     4  45    -0.00   0.00  -0.00     0.00   0.00   0.00     0.00   0.00   0.00
     5   7     0.01  -0.01  -0.01    -0.03   0.01   0.01     0.03  -0.01  -0.01
     6   6     0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00  -0.00  -0.01
     7   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00   0.00   0.01
     8   7     0.01  -0.01   0.01    -0.02   0.02  -0.02     0.02  -0.02   0.01
     9   7    -0.01  -0.01  -0.01    -0.03  -0.02  -0.02    -0.02  -0.02  -0.01
    10   7    -0.02  -0.04   0.00    -0.00  -0.00   0.00     0.01   0.02   0.01
    11   6    -0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.00   0.00  -0.01
    12   1     0.04  -0.10  -0.12    -0.08   0.18   0.21     0.07  -0.18  -0.18
    13   1    -0.01   0.02   0.02     0.01  -0.01  -0.01    -0.01   0.01   0.01
    14   1     0.09   0.00   0.10    -0.20  -0.02  -0.21     0.19   0.02   0.19
    15   1    -0.01   0.01   0.00     0.02  -0.00   0.01    -0.02   0.00  -0.02
    16   1    -0.08   0.00  -0.09    -0.20   0.02  -0.22    -0.19   0.03  -0.19
    17   1     0.01   0.01  -0.01     0.01   0.00   0.01     0.02   0.00   0.02
    18   1    -0.04  -0.09   0.11    -0.09  -0.18   0.22    -0.08  -0.17   0.18
    19   1     0.01   0.02  -0.02     0.02   0.02  -0.02     0.01   0.01  -0.01
    20   1     0.10   0.06   0.05     0.17   0.09   0.10     0.14   0.07   0.07
    21   1     0.16   0.09   0.02     0.28   0.17   0.04     0.25   0.16   0.04
    22   1     0.05   0.03  -0.04     0.17   0.09  -0.09     0.15   0.08  -0.07
    23   1     0.12   0.05  -0.01     0.31   0.17  -0.04     0.26   0.13  -0.03
    24   1    -0.06   0.04   0.04     0.17  -0.10  -0.09    -0.15   0.09   0.07
    25   1    -0.13   0.07   0.01     0.30  -0.18  -0.04    -0.26   0.14   0.03
    26   1    -0.10   0.06  -0.05     0.15  -0.09   0.10    -0.13   0.08  -0.07
    27   1    -0.17   0.11  -0.02     0.27  -0.18   0.04    -0.24   0.17  -0.04
    28   6     0.00  -0.00   0.00     0.00  -0.00  -0.00     0.00   0.00   0.01
    29   7     0.02  -0.04  -0.00    -0.00   0.00   0.00    -0.01   0.02  -0.01
    30   1     0.05   0.43  -0.01     0.00   0.03  -0.01    -0.03  -0.23  -0.01
    31   1     0.11   0.23  -0.04     0.00  -0.00   0.00    -0.05  -0.10   0.03
    32   1    -0.01   0.02   0.01     0.01  -0.02  -0.01    -0.01  -0.03  -0.01
    33   1     0.19  -0.20  -0.22    -0.00   0.00  -0.00    -0.09   0.13   0.14
    34   1    -0.20  -0.20   0.22    -0.01  -0.01   0.01     0.10   0.13  -0.14
    35   1     0.01   0.02  -0.01     0.01   0.02  -0.01     0.00  -0.03   0.01
    36   1    -0.03   0.43   0.01    -0.00  -0.01  -0.01     0.02  -0.24   0.01
    37   1    -0.10   0.23   0.04    -0.00   0.01   0.00     0.05  -0.10  -0.03
                     52                     53                     54
                      A                      A                      A
 Frequencies --   1223.4618              1226.3144              1244.7594
 Red. masses --      1.2544                 1.2485                 1.2398
 Frc consts  --      1.1063                 1.1062                 1.1318
 IR Inten    --      6.1565                 0.1951                32.6750
 RamAct Fr= 1--      5.7811                 6.6455                 0.9828
  Dep-P Fr= 1--      0.7500                 0.7498                 0.7499
  Dep-U Fr= 1--      0.8571                 0.8570                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0000
 Beta2  Fr= 1--      0.8259                 0.9492                 0.1404
 AlphaG Fr= 1--     -0.0000                 0.0000                 0.0000
 Gamma2 Fr= 1--      1.4422                -5.2264                -0.4363
 Delta2 Fr= 1--      0.2091                -0.2529                -0.0482
 Raman1 Fr= 1--      23.124                 26.582                  3.931
 ROA1   Fr= 1--     145.142               -509.830                -43.425
 CID1   Fr= 1--       6.277                -19.179                -11.046
 Raman2 Fr= 1--       9.910                 11.391                  1.685
 ROA2   Fr= 1--      32.940               -123.411                -10.085
 CID2   Fr= 1--       3.324                -10.834                 -5.986
 Raman3 Fr= 1--      19.821                 22.781                  3.369
 ROA3   Fr= 1--     145.142               -509.830                -43.425
 CID3   Fr= 1--       7.323                -22.379                -12.888
 RC180  Fr= 1--       0.714                  0.714                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02  -0.01  -0.01    -0.03  -0.02  -0.02    -0.03  -0.01  -0.01
     2   6     0.01   0.01  -0.01     0.03   0.02  -0.02     0.03   0.02  -0.01
     3   7    -0.02  -0.01   0.02    -0.04  -0.02   0.03    -0.04  -0.02   0.02
     4  45     0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.00   0.00
     5   7    -0.02   0.01   0.02     0.04  -0.02  -0.03    -0.03   0.02   0.02
     6   6     0.01  -0.01  -0.01    -0.03   0.02   0.02     0.03  -0.02  -0.01
     7   6    -0.02   0.01  -0.01     0.03  -0.02   0.02    -0.03   0.01  -0.01
     8   7     0.02  -0.01   0.02    -0.04   0.03  -0.03     0.04  -0.02   0.02
     9   7     0.02   0.01   0.01     0.04   0.02   0.03     0.04   0.02   0.02
    10   7     0.04   0.06  -0.01    -0.00   0.00  -0.01    -0.03  -0.03  -0.00
    11   6    -0.02  -0.05   0.01     0.00  -0.00   0.01     0.01   0.02   0.00
    12   1     0.00  -0.02  -0.07    -0.01   0.02   0.13     0.01  -0.03  -0.11
    13   1     0.01  -0.01  -0.01    -0.01  -0.01  -0.00     0.02  -0.01  -0.01
    14   1    -0.00   0.00  -0.08     0.05   0.01   0.15    -0.01  -0.01  -0.08
    15   1     0.00   0.00  -0.00    -0.02  -0.01  -0.00    -0.03   0.02  -0.03
    16   1    -0.00  -0.00  -0.07    -0.05   0.01  -0.15    -0.01   0.01  -0.08
    17   1     0.00  -0.00  -0.00     0.01  -0.01   0.00    -0.03  -0.01  -0.02
    18   1     0.00   0.02  -0.06     0.01   0.02  -0.13     0.01   0.03  -0.11
    19   1     0.01   0.01  -0.02     0.01  -0.01   0.00     0.02   0.01  -0.01
    20   1    -0.06  -0.03  -0.05    -0.16  -0.08  -0.14    -0.11  -0.06  -0.09
    21   1    -0.16  -0.12  -0.02    -0.33  -0.22  -0.03    -0.33  -0.20  -0.04
    22   1     0.08   0.05  -0.08     0.16   0.09  -0.13     0.12   0.06  -0.08
    23   1     0.18   0.09  -0.01     0.40   0.17  -0.03     0.33   0.17  -0.03
    24   1     0.09  -0.06  -0.08    -0.15   0.10   0.13     0.11  -0.07  -0.08
    25   1     0.20  -0.11  -0.01    -0.38   0.18   0.03     0.32  -0.18  -0.03
    26   1    -0.07   0.04  -0.06     0.15  -0.08   0.14    -0.11   0.06  -0.09
    27   1    -0.17   0.14  -0.02     0.32  -0.23   0.03    -0.32   0.21  -0.04
    28   6    -0.02   0.05   0.01    -0.01   0.00  -0.01     0.01  -0.03   0.00
    29   7     0.03  -0.06  -0.01     0.01  -0.00   0.01    -0.02   0.03  -0.00
    30   1    -0.06  -0.53  -0.01     0.01   0.03   0.02     0.03   0.28   0.02
    31   1    -0.13  -0.18   0.06    -0.00  -0.01  -0.01     0.09   0.13  -0.05
    32   1    -0.02   0.04   0.01     0.02   0.02  -0.00    -0.02   0.05   0.05
    33   1    -0.13   0.01   0.07     0.00  -0.04  -0.04     0.10  -0.05  -0.08
    34   1    -0.13  -0.01   0.07    -0.01  -0.04   0.04     0.11   0.04  -0.08
    35   1    -0.02  -0.04   0.01    -0.02   0.01   0.00    -0.03  -0.05   0.05
    36   1    -0.04   0.53  -0.01    -0.01   0.05  -0.03     0.02  -0.28   0.02
    37   1    -0.12   0.19   0.06    -0.01  -0.00   0.01     0.08  -0.14  -0.05
                     55                     56                     57
                      A                      A                      A
 Frequencies --   1292.2906              1292.6053              1297.3038
 Red. masses --      1.4046                 1.3948                 1.3712
 Frc consts  --      1.3820                 1.3731                 1.3596
 IR Inten    --      0.4428                 0.0353                 1.3624
 RamAct Fr= 1--      2.6492                 6.0032                 2.0317
  Dep-P Fr= 1--      0.5813                 0.0522                 0.6238
  Dep-U Fr= 1--      0.7352                 0.0993                 0.7683
 Alpha2 Fr= 1--      0.0084                 0.1180                 0.0047
 Beta2  Fr= 1--      0.3246                 0.0993                 0.2602
 AlphaG Fr= 1--     -0.0005                -0.0175                 0.0111
 Gamma2 Fr= 1--      0.3736                -1.2950                 1.3780
 Delta2 Fr= 1--      0.1256                -1.1101                 1.0580
 Raman1 Fr= 1--      10.597                 24.013                  8.127
 ROA1   Fr= 1--      39.885               -159.845                166.140
 CID1   Fr= 1--       3.764                 -6.657                 20.444
 Raman2 Fr= 1--       3.895                  1.192                  3.122
 ROA2   Fr= 1--       7.961                -22.199                 24.608
 CID2   Fr= 1--       2.044                -18.625                  7.882
 Raman3 Fr= 1--       7.791                  2.384                  6.244
 ROA3   Fr= 1--      39.885               -159.845                166.140
 CID3   Fr= 1--       5.120                -67.056                 26.609
 RC180  Fr= 1--       0.470                 -0.801                  0.537
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03  -0.05  -0.02    -0.04   0.06   0.03     0.03  -0.05  -0.02
     2   6    -0.03   0.06   0.02     0.03  -0.07  -0.04    -0.02   0.06   0.02
     3   7    -0.00  -0.03  -0.01    -0.00   0.02   0.02    -0.01  -0.02  -0.01
     4  45     0.00   0.00   0.00    -0.00   0.00  -0.00     0.00   0.00   0.00
     5   7     0.00   0.03  -0.02     0.00   0.01  -0.01     0.00  -0.02   0.01
     6   6    -0.05  -0.08   0.04    -0.02  -0.03   0.02     0.02   0.05  -0.02
     7   6     0.05   0.08  -0.04     0.02   0.03  -0.02    -0.03  -0.05   0.02
     8   7    -0.03  -0.01   0.02    -0.01  -0.00   0.01     0.02   0.01  -0.01
     9   7    -0.02   0.01   0.01     0.02  -0.01  -0.02    -0.02   0.01   0.01
    10   7     0.00  -0.01   0.00     0.03  -0.02   0.02     0.02  -0.01   0.01
    11   6    -0.01   0.00  -0.01    -0.06   0.01  -0.06    -0.06   0.00  -0.06
    12   1     0.02  -0.08   0.09    -0.01   0.02   0.06    -0.02   0.06  -0.01
    13   1    -0.05  -0.03  -0.32    -0.02  -0.03  -0.14     0.04  -0.00   0.17
    14   1     0.09   0.02  -0.08    -0.01   0.01  -0.06    -0.06  -0.01   0.03
    15   1    -0.02   0.07   0.31     0.02   0.02   0.13     0.01  -0.04  -0.17
    16   1     0.07  -0.01  -0.03    -0.04   0.01   0.09     0.07  -0.01  -0.03
    17   1    -0.03  -0.04   0.19    -0.00   0.05  -0.26    -0.02  -0.04   0.19
    18   1     0.02   0.07   0.05     0.00  -0.02  -0.10     0.03   0.07   0.02
    19   1    -0.03   0.02  -0.20     0.03  -0.04   0.27    -0.04   0.00  -0.19
    20   1     0.20   0.17  -0.02    -0.23  -0.19   0.02     0.18   0.16  -0.03
    21   1    -0.08  -0.14   0.01     0.08   0.16  -0.01    -0.11  -0.16   0.00
    22   1     0.25   0.08   0.03    -0.27  -0.08  -0.04     0.25   0.08   0.02
    23   1    -0.17   0.01  -0.01     0.21   0.01   0.01    -0.14   0.01  -0.01
    24   1     0.36  -0.13   0.05     0.11  -0.04   0.02    -0.23   0.09  -0.01
    25   1    -0.26   0.00  -0.02    -0.10   0.02  -0.00     0.13   0.00   0.01
    26   1     0.28  -0.26  -0.03     0.10  -0.08  -0.00    -0.16   0.15   0.02
    27   1    -0.11   0.22   0.01    -0.03   0.07   0.01     0.10  -0.16  -0.00
    28   6     0.01  -0.00   0.01     0.06   0.01   0.06     0.06   0.00   0.06
    29   7    -0.01  -0.00  -0.00    -0.03  -0.02  -0.02    -0.02  -0.01  -0.01
    30   1    -0.01  -0.02  -0.03    -0.03  -0.16  -0.11    -0.03  -0.17  -0.10
    31   1     0.00   0.08   0.02     0.00   0.33   0.07     0.00   0.30   0.06
    32   1    -0.06  -0.02   0.03    -0.23  -0.04   0.12    -0.25   0.00   0.15
    33   1     0.01   0.00  -0.01     0.08   0.04   0.01     0.09   0.02  -0.00
    34   1    -0.02   0.02  -0.01    -0.07   0.04  -0.00    -0.09   0.03   0.00
    35   1     0.05  -0.01  -0.02     0.23  -0.06  -0.13     0.25  -0.01  -0.15
    36   1     0.01  -0.05   0.02     0.02  -0.15   0.11     0.02  -0.18   0.10
    37   1     0.00   0.07  -0.02     0.01   0.33  -0.07     0.01   0.30  -0.06
                     58                     59                     60
                      A                      A                      A
 Frequencies --   1331.4597              1333.7213              1340.3173
 Red. masses --      1.1857                 1.1927                 1.1701
 Frc consts  --      1.2385                 1.2500                 1.2384
 IR Inten    --     24.5007                27.3947                 0.0260
 RamAct Fr= 1--      3.1479                 3.2575                 2.4828
  Dep-P Fr= 1--      0.7500                 0.7480                 0.2749
  Dep-U Fr= 1--      0.8571                 0.8558                 0.4312
 Alpha2 Fr= 1--      0.0000                 0.0001                 0.0274
 Beta2  Fr= 1--      0.4497                 0.4647                 0.1784
 AlphaG Fr= 1--      0.0000                 0.0047                 0.0178
 Gamma2 Fr= 1--     -5.3866                 3.2880                -2.5242
 Delta2 Fr= 1--     -5.4843                 1.6201                -1.9689
 Raman1 Fr= 1--      12.591                 13.030                  9.931
 ROA1   Fr= 1--    -692.615                367.495               -305.325
 CID1   Fr= 1--     -55.007                 28.204                -30.744
 Raman2 Fr= 1--       5.396                  5.576                  2.141
 ROA2   Fr= 1--     -85.405                 65.952                -44.829
 CID2   Fr= 1--     -15.827                 11.828                -20.937
 Raman3 Fr= 1--      10.792                 11.152                  4.282
 ROA3   Fr= 1--    -692.615                367.495               -305.325
 CID3   Fr= 1--     -64.176                 32.954                -71.301
 RC180  Fr= 1--       0.714                  0.712                 -0.138
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.01   0.00   0.04     0.01  -0.01   0.02    -0.01   0.01  -0.03
     2   6     0.00   0.01  -0.04    -0.00   0.01  -0.02    -0.01  -0.00   0.02
     3   7    -0.02  -0.04   0.01    -0.01  -0.03   0.01     0.02   0.02  -0.01
     4  45     0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   7    -0.02   0.04   0.01     0.01  -0.02  -0.01    -0.01   0.02   0.01
     6   6     0.00  -0.01  -0.04     0.00   0.01   0.02     0.01  -0.00  -0.02
     7   6     0.01   0.00   0.04    -0.01  -0.01  -0.02     0.01   0.01   0.03
     8   7    -0.04  -0.00  -0.02     0.02   0.00   0.00    -0.04  -0.00  -0.01
     9   7    -0.04   0.00  -0.02    -0.02   0.00  -0.01     0.04  -0.00   0.01
    10   7     0.00  -0.00   0.00    -0.01  -0.04   0.03     0.00  -0.03   0.02
    11   6    -0.00  -0.00  -0.00     0.04   0.01  -0.02     0.02   0.01  -0.02
    12   1     0.10  -0.25  -0.19    -0.06   0.14   0.12     0.10  -0.22  -0.19
    13   1    -0.07   0.15   0.22     0.05  -0.08  -0.09    -0.09   0.17   0.19
    14   1     0.28   0.02   0.23    -0.15  -0.01  -0.10     0.14   0.01   0.10
    15   1    -0.18  -0.01  -0.23     0.08   0.00   0.10    -0.10  -0.01  -0.16
    16   1     0.27  -0.03   0.22     0.18  -0.02   0.12    -0.16   0.02  -0.12
    17   1    -0.17   0.01  -0.22    -0.10   0.01  -0.12     0.12  -0.01   0.17
    18   1     0.10   0.23  -0.17     0.07   0.14  -0.12    -0.10  -0.20   0.17
    19   1    -0.07  -0.14   0.20    -0.05  -0.09   0.10     0.09   0.16  -0.19
    20   1     0.13   0.11   0.06     0.10   0.08   0.02    -0.16  -0.13  -0.05
    21   1     0.13   0.05   0.02     0.05   0.00   0.01    -0.13  -0.03  -0.02
    22   1     0.18   0.06  -0.05     0.14   0.05  -0.04    -0.13  -0.05   0.03
    23   1     0.08   0.09  -0.02     0.06   0.05  -0.01    -0.10  -0.06   0.01
    24   1     0.19  -0.07  -0.06    -0.12   0.05   0.03     0.11  -0.05  -0.03
    25   1     0.08  -0.10  -0.02    -0.05   0.05   0.01     0.11  -0.06  -0.01
    26   1     0.14  -0.12   0.07    -0.09   0.08  -0.02     0.17  -0.15   0.05
    27   1     0.14  -0.05   0.02    -0.04  -0.00  -0.01     0.13  -0.03   0.02
    28   6     0.00   0.00  -0.00    -0.04   0.01   0.02    -0.02   0.01   0.02
    29   7     0.00   0.00   0.00     0.01  -0.04  -0.03    -0.00  -0.03  -0.02
    30   1    -0.00  -0.01  -0.01     0.01   0.16  -0.04     0.00   0.09  -0.04
    31   1    -0.01   0.02   0.01     0.08   0.21   0.01     0.05   0.22   0.02
    32   1    -0.01  -0.02  -0.00     0.20  -0.16  -0.19     0.09  -0.13  -0.11
    33   1    -0.02   0.01   0.01    -0.15   0.26   0.26    -0.09   0.17   0.16
    34   1    -0.03  -0.02   0.02     0.16   0.25  -0.25     0.10   0.17  -0.16
    35   1     0.01   0.03  -0.01    -0.20  -0.15   0.19    -0.10  -0.13   0.11
    36   1    -0.00   0.00  -0.01    -0.00   0.16   0.04    -0.00   0.09   0.04
    37   1    -0.00  -0.03   0.01    -0.07   0.21  -0.01    -0.04   0.22  -0.02
                     61                     62                     63
                      A                      A                      A
 Frequencies --   1347.5049              1348.6581              1350.4537
 Red. masses --      1.1947                 1.1898                 1.1935
 Frc consts  --      1.2781                 1.2751                 1.2824
 IR Inten    --      8.2756                 1.8523                 9.5788
 RamAct Fr= 1--      3.5970                11.4463                 9.3774
  Dep-P Fr= 1--      0.7488                 0.7483                 0.7500
  Dep-U Fr= 1--      0.8563                 0.8560                 0.8571
 Alpha2 Fr= 1--      0.0001                 0.0003                 0.0000
 Beta2  Fr= 1--      0.5134                 1.6330                 1.3396
 AlphaG Fr= 1--      0.0001                 0.0007                 0.0000
 Gamma2 Fr= 1--      3.8640                13.7461                -7.1023
 Delta2 Fr= 1--      0.8082                 3.2047                -0.4905
 Raman1 Fr= 1--      14.388                 45.785                 37.510
 ROA1   Fr= 1--     396.805               1422.173               -697.514
 CID1   Fr= 1--      27.579                 31.062                -18.596
 Raman2 Fr= 1--       6.161                 19.596                 16.075
 ROA2   Fr= 1--      86.270                304.268               -166.531
 CID2   Fr= 1--      14.004                 15.527                -10.359
 Raman3 Fr= 1--      12.321                 39.192                 32.151
 ROA3   Fr= 1--     396.805               1422.173               -697.514
 CID3   Fr= 1--      32.205                 36.287                -21.695
 RC180  Fr= 1--       0.713                  0.712                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01   0.04  -0.01    -0.00   0.05  -0.00     0.00   0.01  -0.00
     2   6    -0.03   0.02  -0.01    -0.03   0.03  -0.01    -0.01   0.00  -0.00
     3   7    -0.00  -0.04  -0.00    -0.01  -0.05  -0.00     0.00  -0.01  -0.00
     4  45     0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
     5   7    -0.00   0.04  -0.00     0.01  -0.04   0.00     0.00   0.01  -0.00
     6   6    -0.04  -0.03  -0.01     0.03   0.03   0.01    -0.01  -0.00  -0.00
     7   6    -0.01  -0.05  -0.01     0.00   0.04   0.00     0.00  -0.01   0.00
     8   7     0.04   0.01  -0.00    -0.03  -0.01   0.00     0.00   0.00  -0.00
     9   7     0.04  -0.02   0.00     0.03  -0.02  -0.00     0.00  -0.00  -0.00
    10   7     0.00  -0.01   0.01     0.00   0.00  -0.00    -0.02   0.04  -0.04
    11   6    -0.00  -0.01  -0.01    -0.00   0.00   0.00     0.01   0.03   0.06
    12   1    -0.11   0.23   0.26     0.09  -0.20  -0.20    -0.01   0.03   0.04
    13   1     0.11  -0.16  -0.06    -0.07   0.11   0.03     0.01  -0.01   0.01
    14   1     0.25   0.01   0.26    -0.27  -0.01  -0.27     0.05   0.00   0.06
    15   1    -0.18   0.02  -0.07     0.19  -0.02   0.10    -0.04   0.00  -0.03
    16   1     0.21  -0.01   0.23     0.28  -0.02   0.28     0.05  -0.00   0.06
    17   1    -0.15  -0.01  -0.05    -0.20  -0.01  -0.10    -0.04  -0.00  -0.02
    18   1    -0.13  -0.23   0.27    -0.11  -0.21   0.23    -0.02  -0.03   0.05
    19   1     0.12   0.15  -0.07     0.09   0.12  -0.04     0.01   0.01   0.01
    20   1    -0.21  -0.19  -0.02    -0.19  -0.17  -0.01    -0.01  -0.02   0.01
    21   1    -0.02   0.08  -0.01     0.00   0.09  -0.01     0.04   0.04   0.00
    22   1     0.21   0.06  -0.00     0.30   0.09  -0.01     0.05   0.01   0.00
    23   1    -0.08   0.04  -0.01    -0.05   0.05  -0.02    -0.03   0.00  -0.00
    24   1     0.25  -0.08  -0.01    -0.28   0.10   0.01     0.04  -0.01   0.00
    25   1    -0.08  -0.05  -0.02     0.04   0.05   0.02    -0.03  -0.00  -0.00
    26   1    -0.20   0.20  -0.02     0.16  -0.16   0.01    -0.01   0.01   0.01
    27   1    -0.01  -0.09  -0.01    -0.00   0.08   0.01     0.04  -0.04   0.01
    28   6    -0.00   0.01  -0.01     0.00   0.00  -0.01     0.00  -0.03   0.06
    29   7     0.00   0.01   0.01    -0.00   0.01   0.00    -0.02  -0.04  -0.04
    30   1    -0.00  -0.01  -0.02    -0.00  -0.02   0.01     0.02   0.03   0.11
    31   1     0.01   0.06   0.01    -0.01  -0.03   0.00    -0.05  -0.37  -0.07
    32   1     0.01  -0.03  -0.03    -0.02   0.00   0.02    -0.04   0.21   0.12
    33   1    -0.04   0.06   0.07     0.01  -0.03  -0.03     0.27  -0.30  -0.30
    34   1    -0.03  -0.05   0.06    -0.01  -0.04   0.04     0.28   0.29  -0.31
    35   1     0.01   0.02  -0.02     0.02   0.01  -0.02    -0.04  -0.21   0.12
    36   1    -0.00   0.02  -0.01    -0.00  -0.02  -0.01     0.02  -0.03   0.11
    37   1     0.01  -0.05   0.01     0.01  -0.04  -0.00    -0.04   0.38  -0.07
                     64                     65                     66
                      A                      A                      A
 Frequencies --   1404.6482              1405.3722              1406.9164
 Red. masses --      1.2658                 1.2682                 1.2640
 Frc consts  --      1.4714                 1.4757                 1.4741
 IR Inten    --      0.5887                 1.1744                 1.3061
 RamAct Fr= 1--      0.7830                 2.1429                 1.5114
  Dep-P Fr= 1--      0.7500                 0.7499                 0.7500
  Dep-U Fr= 1--      0.8571                 0.8571                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0000
 Beta2  Fr= 1--      0.1119                 0.3061                 0.2159
 AlphaG Fr= 1--      0.0000                -0.0000                 0.0000
 Gamma2 Fr= 1--     -0.7275                -2.7143                 2.0723
 Delta2 Fr= 1--     -0.2801                -1.1512                 1.0069
 Raman1 Fr= 1--       3.132                  8.572                  6.046
 ROA1   Fr= 1--     -78.800               -297.413                231.163
 CID1   Fr= 1--     -25.161                -34.697                 38.235
 Raman2 Fr= 1--       1.342                  3.673                  2.591
 ROA2   Fr= 1--     -15.219                -55.934                 41.681
 CID2   Fr= 1--     -11.339                -15.227                 16.087
 Raman3 Fr= 1--       2.684                  7.347                  5.182
 ROA3   Fr= 1--     -78.800               -297.413                231.163
 CID3   Fr= 1--     -29.355                -40.483                 44.608
 RC180  Fr= 1--       0.714                  0.714                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.03   0.02  -0.05     0.04   0.02  -0.06    -0.01  -0.01   0.02
     2   6    -0.03  -0.01  -0.05    -0.04  -0.02  -0.07     0.01   0.00   0.02
     3   7    -0.01   0.01   0.01    -0.01   0.01   0.02     0.01  -0.00  -0.01
     4  45    -0.00  -0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
     5   7    -0.01  -0.01   0.02     0.01   0.01  -0.02     0.01   0.00  -0.01
     6   6    -0.04   0.02  -0.06     0.03  -0.02   0.05     0.01  -0.01   0.02
     7   6     0.04  -0.03  -0.06    -0.03   0.02   0.05    -0.01   0.01   0.02
     8   7    -0.00  -0.02   0.02     0.00   0.01  -0.01    -0.00   0.01  -0.01
     9   7    -0.00   0.01   0.02    -0.00   0.02   0.02    -0.00  -0.01  -0.01
    10   7    -0.01  -0.00  -0.00    -0.00  -0.00   0.00    -0.03  -0.01  -0.01
    11   6     0.02  -0.02  -0.01     0.01  -0.01  -0.00     0.07  -0.06  -0.03
    12   1    -0.07   0.16   0.23     0.06  -0.12  -0.20     0.02  -0.05  -0.06
    13   1    -0.14   0.27   0.24     0.09  -0.21  -0.20     0.04  -0.07  -0.06
    14   1     0.16   0.00   0.25    -0.13  -0.00  -0.21    -0.05  -0.00  -0.07
    15   1     0.29   0.01   0.26    -0.25  -0.01  -0.23    -0.09   0.00  -0.08
    16   1     0.12  -0.01   0.19     0.17  -0.01   0.26    -0.06   0.01  -0.07
    17   1     0.22  -0.02   0.20     0.31  -0.03   0.29    -0.10   0.00  -0.09
    18   1    -0.06  -0.12   0.17    -0.08  -0.15   0.25     0.02   0.05  -0.06
    19   1    -0.12  -0.21   0.19    -0.13  -0.26   0.25     0.04   0.08  -0.06
    20   1     0.08   0.08  -0.02     0.10   0.10  -0.02    -0.02  -0.03   0.01
    21   1    -0.06  -0.08   0.01    -0.08  -0.10   0.01     0.04   0.04   0.00
    22   1    -0.09  -0.02  -0.02    -0.15  -0.04  -0.03     0.04   0.01   0.01
    23   1     0.10   0.01   0.01     0.13   0.02   0.01    -0.06  -0.01  -0.00
    24   1    -0.13   0.04  -0.03     0.12  -0.03   0.03     0.03  -0.01   0.01
    25   1     0.13  -0.02   0.01    -0.10   0.03  -0.01    -0.06   0.01  -0.00
    26   1     0.10  -0.11  -0.02    -0.07   0.08   0.02    -0.02   0.02   0.01
    27   1    -0.07   0.11   0.01     0.06  -0.08  -0.00     0.04  -0.04   0.00
    28   6     0.03   0.02  -0.01     0.00   0.00   0.00     0.07   0.05  -0.03
    29   7    -0.01   0.00  -0.00     0.00  -0.00  -0.00    -0.03   0.01  -0.01
    30   1     0.00   0.05   0.02     0.00   0.02   0.00     0.02   0.15   0.07
    31   1     0.00  -0.06  -0.02     0.00  -0.02  -0.01     0.01  -0.18  -0.06
    32   1    -0.08   0.09   0.11    -0.02   0.04   0.03    -0.23   0.32   0.30
    33   1    -0.09   0.05   0.05    -0.01   0.02   0.02    -0.24   0.17   0.20
    34   1    -0.09  -0.05   0.06    -0.02   0.00  -0.00    -0.25  -0.16   0.20
    35   1    -0.09  -0.10   0.11    -0.01   0.01   0.01    -0.24  -0.31   0.31
    36   1     0.00  -0.05   0.02     0.00  -0.00   0.00     0.01  -0.15   0.07
    37   1     0.01   0.06  -0.02    -0.00   0.00   0.00     0.01   0.18  -0.06
                     67                     68                     69
                      A                      A                      A
 Frequencies --   1443.1507              1444.8377              1445.3761
 Red. masses --      1.4462                 1.4516                 1.4413
 Frc consts  --      1.7746                 1.7853                 1.7740
 IR Inten    --      3.8377                 0.8426                 2.5602
 RamAct Fr= 1--      0.4269                 0.2966                 0.8905
  Dep-P Fr= 1--      0.7489                 0.6243                 0.6707
  Dep-U Fr= 1--      0.8564                 0.7687                 0.8029
 Alpha2 Fr= 1--      0.0000                 0.0007                 0.0013
 Beta2  Fr= 1--      0.0609                 0.0380                 0.1192
 AlphaG Fr= 1--     -0.0002                 0.0030                -0.0394
 Gamma2 Fr= 1--      0.9012                -1.0851                 0.1654
 Delta2 Fr= 1--      0.5861                -0.6996                 0.3079
 Raman1 Fr= 1--       1.707                  1.187                  3.562
 ROA1   Fr= 1--     105.276               -126.558                 25.730
 CID1   Fr= 1--      61.658               -106.661                  7.223
 Raman2 Fr= 1--       0.731                  0.456                  1.430
 ROA2   Fr= 1--      16.941                -20.447                  1.506
 CID2   Fr= 1--      23.171                -44.833                  1.053
 Raman3 Fr= 1--       1.462                  0.912                  2.860
 ROA3   Fr= 1--     105.276               -126.558                 25.730
 CID3   Fr= 1--      71.996               -138.750                  8.997
 RC180  Fr= 1--       0.713                  0.537                  0.606
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.03   0.08     0.00   0.01  -0.03    -0.01  -0.03   0.09
     2   6    -0.03   0.01  -0.08     0.01  -0.00   0.04    -0.03   0.01  -0.09
     3   7    -0.01   0.01   0.02     0.00  -0.00  -0.01    -0.01   0.00   0.02
     4  45     0.00  -0.00  -0.00    -0.00   0.00  -0.00     0.00   0.00  -0.00
     5   7    -0.01  -0.00   0.03    -0.00  -0.00   0.01     0.01   0.00  -0.02
     6   6    -0.03  -0.01  -0.10    -0.01  -0.00  -0.03     0.03   0.01   0.07
     7   6    -0.01   0.04   0.10     0.00   0.01   0.03     0.01  -0.03  -0.08
     8   7    -0.00   0.01  -0.03    -0.00   0.00  -0.01     0.00  -0.01   0.02
     9   7    -0.00  -0.01  -0.02     0.00   0.00   0.01    -0.00  -0.01  -0.03
    10   7    -0.00  -0.00   0.00    -0.04  -0.01  -0.00    -0.01  -0.00  -0.00
    11   6     0.00  -0.00  -0.00     0.10  -0.03  -0.07     0.04  -0.01  -0.02
    12   1     0.09  -0.09  -0.17     0.03  -0.04  -0.05    -0.07   0.10   0.14
    13   1     0.08  -0.28  -0.33     0.02  -0.07  -0.08    -0.08   0.24   0.26
    14   1     0.12  -0.04   0.18     0.02  -0.02   0.07    -0.10   0.02  -0.13
    15   1     0.27   0.06   0.34     0.07   0.04   0.12    -0.21  -0.04  -0.25
    16   1     0.10   0.03   0.15    -0.03  -0.03  -0.08     0.11   0.03   0.15
    17   1     0.23  -0.06   0.29    -0.08   0.04  -0.14     0.24  -0.06   0.29
    18   1     0.08   0.08  -0.15    -0.03  -0.04   0.06     0.09   0.11  -0.16
    19   1     0.08   0.24  -0.29    -0.03  -0.08   0.11     0.11   0.27  -0.31
    20   1    -0.05  -0.07   0.06    -0.00   0.01  -0.02    -0.06  -0.08   0.06
    21   1     0.11   0.08  -0.00    -0.04  -0.03   0.00     0.13   0.11  -0.00
    22   1    -0.08  -0.01  -0.05     0.03   0.00   0.02    -0.07  -0.01  -0.07
    23   1     0.12   0.04   0.01    -0.05  -0.02  -0.00     0.14   0.06   0.00
    24   1    -0.09   0.02  -0.06    -0.02   0.00  -0.02     0.06  -0.01   0.06
    25   1     0.14  -0.05   0.01     0.04  -0.02   0.00    -0.12   0.06  -0.00
    26   1    -0.06   0.08   0.07     0.01   0.00   0.02     0.05  -0.07  -0.05
    27   1     0.12  -0.10  -0.00     0.03  -0.03   0.00    -0.11   0.10   0.00
    28   6    -0.00   0.00   0.00    -0.10  -0.03   0.07    -0.04  -0.01   0.02
    29   7    -0.00   0.00  -0.00     0.03  -0.01   0.00     0.01  -0.00   0.00
    30   1     0.00   0.02  -0.00     0.01   0.20   0.03     0.00   0.06   0.02
    31   1     0.01  -0.01  -0.01     0.06  -0.11  -0.07     0.01  -0.06  -0.02
    32   1     0.00   0.02   0.00    -0.30   0.25   0.37    -0.12   0.09   0.15
    33   1     0.01   0.01   0.01    -0.19   0.16   0.11    -0.08   0.04   0.02
    34   1     0.01  -0.00   0.01     0.20   0.15  -0.11     0.08   0.04  -0.02
    35   1     0.00  -0.02  -0.00     0.31   0.24  -0.37     0.12   0.08  -0.15
    36   1    -0.00  -0.01  -0.00     0.00   0.20  -0.03    -0.00   0.05  -0.02
    37   1     0.00   0.01  -0.00    -0.06  -0.11   0.07    -0.01  -0.06   0.02
                     70                     71                     72
                      A                      A                      A
 Frequencies --   1502.8905              1503.4571              1503.9151
 Red. masses --      1.0801                 1.0800                 1.0826
 Frc consts  --      1.4374                 1.4384                 1.4427
 IR Inten    --     32.4558                25.4529                16.8824
 RamAct Fr= 1--      4.5870                 9.0416                 7.3535
  Dep-P Fr= 1--      0.6498                 0.5538                 0.3245
  Dep-U Fr= 1--      0.7877                 0.7128                 0.4900
 Alpha2 Fr= 1--      0.0083                 0.0338                 0.0700
 Beta2  Fr= 1--      0.6022                 1.0742                 0.6006
 AlphaG Fr= 1--      0.0010                 0.0777                 0.0637
 Gamma2 Fr= 1--     -1.0015                 0.4354                -0.3113
 Delta2 Fr= 1--     -1.0693                 0.4827                 0.6642
 Raman1 Fr= 1--      18.348                 36.166                 29.414
 ROA1   Fr= 1--    -130.363                 57.247                 -8.628
 CID1   Fr= 1--      -7.105                  1.583                 -0.293
 Raman2 Fr= 1--       7.227                 12.890                  7.207
 ROA2   Fr= 1--     -15.482                  6.588                -12.784
 CID2   Fr= 1--      -2.142                  0.511                 -1.774
 Raman3 Fr= 1--      14.453                 25.781                 14.413
 ROA3   Fr= 1--    -130.363                 57.247                 -8.628
 CID3   Fr= 1--      -9.020                  2.221                 -0.599
 RC180  Fr= 1--       0.575                  0.426                 -0.020
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.01  -0.01     0.00   0.00   0.00    -0.03  -0.04  -0.05
     2   6    -0.01  -0.00   0.01     0.02  -0.00  -0.02     0.01  -0.00  -0.01
     3   7    -0.00   0.00   0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     4  45     0.00   0.00  -0.00     0.00   0.00   0.00     0.00  -0.00   0.00
     5   7    -0.00  -0.00   0.00     0.00  -0.00   0.00     0.00  -0.00  -0.00
     6   6    -0.01   0.00   0.00     0.01   0.00  -0.02     0.01   0.00  -0.01
     7   6    -0.01   0.02  -0.02    -0.03   0.05  -0.05     0.00  -0.00   0.00
     8   7    -0.00   0.00  -0.00    -0.01   0.01  -0.00     0.00  -0.00  -0.00
     9   7    -0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.01  -0.01  -0.00
    10   7    -0.00  -0.01  -0.00     0.00   0.00  -0.00     0.00   0.00   0.00
    11   6    -0.05  -0.04  -0.01     0.01   0.01   0.00     0.01   0.02   0.01
    12   1    -0.05  -0.21   0.14    -0.12  -0.52   0.33     0.00   0.01  -0.01
    13   1     0.22  -0.04   0.11     0.54  -0.13   0.26    -0.01   0.01   0.00
    14   1     0.06   0.05  -0.05    -0.11  -0.08   0.08    -0.11  -0.08   0.09
    15   1     0.07  -0.06  -0.01    -0.05   0.11   0.09    -0.08   0.11   0.07
    16   1     0.06  -0.05  -0.05    -0.12   0.11   0.10    -0.08   0.06   0.06
    17   1     0.07   0.06  -0.02    -0.11  -0.13   0.08    -0.04  -0.08   0.08
    18   1    -0.01   0.07   0.05     0.00  -0.01  -0.01    -0.09   0.50   0.32
    19   1     0.07   0.01   0.04    -0.02  -0.01   0.00     0.52   0.09   0.26
    20   1     0.02   0.01   0.00    -0.01  -0.01   0.01     0.02   0.01  -0.01
    21   1     0.00   0.00   0.00    -0.00  -0.01   0.00     0.00   0.00  -0.00
    22   1    -0.01  -0.01   0.01    -0.03  -0.01   0.01    -0.01  -0.00   0.02
    23   1     0.01  -0.01   0.00     0.01  -0.01   0.00     0.03  -0.02   0.00
    24   1    -0.01   0.00   0.01    -0.01   0.00   0.02    -0.03   0.01   0.01
    25   1     0.02   0.01   0.00     0.03   0.02   0.00     0.00   0.01   0.00
    26   1     0.03  -0.02  -0.00     0.00   0.00  -0.02    -0.01   0.01   0.00
    27   1     0.00   0.00   0.00     0.00  -0.01  -0.00     0.00   0.01  -0.00
    28   6    -0.03   0.02  -0.00     0.02  -0.01   0.00    -0.02   0.02  -0.01
    29   7    -0.00   0.01   0.00     0.00  -0.00   0.00    -0.00   0.00  -0.00
    30   1    -0.00   0.01  -0.01     0.00  -0.00   0.01    -0.01  -0.02  -0.02
    31   1    -0.00   0.00  -0.00    -0.00  -0.00   0.00     0.01   0.01  -0.00
    32   1     0.16   0.46  -0.22    -0.04  -0.09   0.05    -0.03  -0.19   0.05
    33   1     0.42   0.15   0.32    -0.09  -0.03  -0.06    -0.15  -0.05  -0.11
    34   1     0.25  -0.11   0.19    -0.15   0.06  -0.12     0.19  -0.07   0.14
    35   1     0.11  -0.27  -0.16    -0.05   0.17   0.08     0.04  -0.23  -0.08
    36   1    -0.01   0.00  -0.02    -0.00   0.01   0.00     0.00  -0.01   0.02
    37   1     0.01  -0.01  -0.00     0.00  -0.00   0.00    -0.01   0.00   0.00
                     73                     74                     75
                      A                      A                      A
 Frequencies --   1504.1808              1504.5459              1504.6550
 Red. masses --      1.0781                 1.0812                 1.0803
 Frc consts  --      1.4372                 1.4420                 1.4410
 IR Inten    --     17.4289                 4.2720                 4.0652
 RamAct Fr= 1--      5.9580                 6.1795                 9.9198
  Dep-P Fr= 1--      0.4771                 0.7224                 0.6062
  Dep-U Fr= 1--      0.6459                 0.8388                 0.7548
 Alpha2 Fr= 1--      0.0326                 0.0029                 0.0263
 Beta2  Fr= 1--      0.6414                 0.8639                 1.2479
 AlphaG Fr= 1--     -0.0532                 0.0408                 0.0838
 Gamma2 Fr= 1--     -3.5862                 3.0384                -2.1854
 Delta2 Fr= 1--     -2.1126                 1.7942                -0.2803
 Raman1 Fr= 1--      23.832                 24.718                 39.679
 ROA1   Fr= 1--    -411.875                349.104               -218.768
 CID1   Fr= 1--     -17.282                 14.123                 -5.513
 Raman2 Fr= 1--       7.697                 10.367                 14.975
 ROA2   Fr= 1--     -69.167                 58.569                -50.206
 CID2   Fr= 1--      -8.986                  5.649                 -3.353
 Raman3 Fr= 1--      15.394                 20.734                 29.950
 ROA3   Fr= 1--    -411.875                349.104               -218.768
 CID3   Fr= 1--     -26.755                 16.837                 -7.305
 RC180  Fr= 1--       0.292                  0.678                  0.510
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.01  -0.01    -0.02  -0.02  -0.01     0.01   0.01   0.01
     2   6     0.04   0.00  -0.03    -0.04  -0.00   0.03    -0.01   0.00   0.01
     3   7     0.01   0.00  -0.00    -0.01   0.00   0.00    -0.00  -0.00   0.00
     4  45    -0.00  -0.00   0.00     0.00   0.00   0.00    -0.00   0.00   0.00
     5   7     0.00   0.00  -0.00    -0.00  -0.00  -0.00     0.01  -0.00  -0.00
     6   6     0.01  -0.00  -0.00     0.00   0.00  -0.00     0.06  -0.00  -0.04
     7   6     0.01  -0.01   0.01    -0.00   0.00  -0.00     0.01  -0.01  -0.00
     8   7    -0.00  -0.00   0.00    -0.00  -0.00  -0.00    -0.00  -0.01   0.00
     9   7    -0.00  -0.00   0.00     0.00  -0.01  -0.00     0.00   0.00   0.00
    10   7    -0.00  -0.01  -0.00    -0.00  -0.00  -0.00     0.00   0.00   0.00
    11   6    -0.02  -0.03  -0.01    -0.01  -0.01  -0.00    -0.01  -0.01   0.00
    12   1     0.04   0.15  -0.10    -0.01  -0.03   0.02     0.02   0.06  -0.04
    13   1    -0.17   0.06  -0.06     0.03  -0.00   0.02    -0.09   0.06   0.02
    14   1    -0.04  -0.03   0.03    -0.01  -0.01   0.01    -0.45  -0.35   0.34
    15   1    -0.04   0.04   0.01     0.00   0.01   0.01    -0.41   0.46   0.22
    16   1    -0.29   0.25   0.23     0.31  -0.27  -0.24     0.08  -0.06  -0.06
    17   1    -0.28  -0.30   0.16     0.32   0.32  -0.15     0.06   0.08  -0.05
    18   1    -0.02   0.13   0.08    -0.05   0.24   0.15     0.02  -0.12  -0.08
    19   1     0.13   0.01   0.09     0.28   0.10   0.07    -0.13  -0.02  -0.06
    20   1    -0.01  -0.01   0.00    -0.03  -0.02  -0.03     0.00   0.00   0.00
    21   1     0.00  -0.02   0.00    -0.00   0.05  -0.01    -0.00   0.00   0.00
    22   1     0.01   0.00  -0.01    -0.00   0.00   0.03     0.00   0.00  -0.00
    23   1    -0.01   0.01  -0.00     0.03  -0.02   0.01    -0.01   0.01  -0.00
    24   1    -0.01   0.00  -0.01    -0.01   0.01   0.01     0.01  -0.00  -0.03
    25   1    -0.01  -0.01  -0.00     0.01   0.01   0.00    -0.03  -0.02  -0.01
    26   1     0.02  -0.01   0.02     0.00  -0.00   0.00     0.01  -0.01   0.03
    27   1     0.00   0.02   0.00     0.00   0.00   0.00     0.01   0.05   0.01
    28   6     0.02  -0.03   0.01     0.03  -0.03   0.01    -0.00   0.01  -0.00
    29   7     0.01  -0.01   0.00     0.00  -0.01   0.00    -0.00   0.00   0.00
    30   1     0.01   0.02   0.03     0.01   0.01   0.03    -0.01  -0.04  -0.01
    31   1    -0.02  -0.00   0.01    -0.02  -0.01   0.01     0.00   0.00  -0.00
    32   1     0.07   0.33  -0.10     0.01   0.11  -0.01     0.04   0.09  -0.06
    33   1     0.27   0.10   0.21     0.08   0.02   0.06     0.09   0.02   0.06
    34   1    -0.25   0.10  -0.19    -0.31   0.12  -0.23     0.04  -0.03   0.04
    35   1    -0.05   0.32   0.09    -0.09   0.37   0.15     0.02  -0.06  -0.02
    36   1    -0.01   0.04  -0.04     0.00  -0.01  -0.01     0.00  -0.01  -0.00
    37   1     0.02  -0.01  -0.01     0.01  -0.00  -0.00     0.00  -0.00  -0.00
                     76                     77                     78
                      A                      A                      A
 Frequencies --   1639.9358              1656.5006              1656.6707
 Red. masses --      1.0767                 1.0790                 1.0792
 Frc consts  --      1.7061                 1.7444                 1.7451
 IR Inten    --    124.8045                38.2782                17.6612
 RamAct Fr= 1--      0.2501                 4.3774                 8.1777
  Dep-P Fr= 1--      0.7500                 0.7495                 0.7500
  Dep-U Fr= 1--      0.8571                 0.8568                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0000
 Beta2  Fr= 1--      0.0357                 0.6251                 1.1682
 AlphaG Fr= 1--      0.0000                 0.0012                -0.0000
 Gamma2 Fr= 1--      0.0927                 2.0389                 5.0376
 Delta2 Fr= 1--      0.1055                 3.7931                 6.3801
 Raman1 Fr= 1--       1.000                 17.509                 32.711
 ROA1   Fr= 1--      12.275                317.113                687.770
 CID1   Fr= 1--      12.272                 18.111                 21.026
 Raman2 Fr= 1--       0.429                  7.501                 14.019
 ROA2   Fr= 1--       1.380                 18.589                 69.861
 CID2   Fr= 1--       3.220                  2.478                  4.983
 Raman3 Fr= 1--       0.857                 15.002                 28.038
 ROA3   Fr= 1--      12.275                317.113                687.770
 CID3   Fr= 1--      14.318                 21.138                 24.530
 RC180  Fr= 1--       0.714                  0.714                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00     0.01  -0.00   0.01     0.00   0.00   0.01
     2   6     0.00   0.00  -0.00    -0.00  -0.00  -0.00     0.00   0.00  -0.01
     3   7    -0.02   0.01  -0.02     0.01  -0.01   0.01    -0.02   0.02  -0.02
     4  45    -0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00  -0.00   0.00
     5   7    -0.02  -0.01  -0.02     0.00   0.00   0.00    -0.03  -0.02  -0.03
     6   6     0.00  -0.00  -0.00    -0.00  -0.00   0.00     0.00  -0.01  -0.01
     7   6    -0.00  -0.00  -0.00    -0.01  -0.00  -0.01     0.00  -0.00   0.01
     8   7    -0.00  -0.03  -0.02    -0.00  -0.04  -0.03     0.00   0.01   0.01
     9   7    -0.00   0.02  -0.02     0.00  -0.03   0.02     0.00  -0.02   0.01
    10   7     0.01  -0.01  -0.03     0.01  -0.01  -0.03    -0.00   0.01   0.01
    11   6     0.00   0.00  -0.00     0.01   0.00  -0.01     0.00  -0.00   0.00
    12   1    -0.01   0.02   0.00    -0.02   0.00   0.02     0.01   0.02  -0.03
    13   1    -0.00  -0.00  -0.00     0.02  -0.01   0.00    -0.03   0.00  -0.01
    14   1     0.01  -0.00   0.00     0.01   0.01  -0.02     0.01  -0.02   0.02
    15   1    -0.01  -0.00  -0.00     0.01  -0.01  -0.01    -0.02   0.02   0.00
    16   1     0.01   0.00   0.00    -0.01   0.00   0.01     0.01   0.02   0.02
    17   1    -0.01   0.00  -0.00     0.00  -0.01   0.01    -0.02  -0.01  -0.00
    18   1    -0.01  -0.02   0.00     0.01   0.01  -0.01     0.02  -0.01  -0.03
    19   1    -0.00   0.00  -0.00    -0.01  -0.01   0.00    -0.03  -0.00  -0.01
    20   1    -0.06  -0.09   0.29     0.08   0.12  -0.36     0.04   0.06  -0.21
    21   1     0.13  -0.28   0.02    -0.15   0.36  -0.02    -0.09   0.21  -0.01
    22   1     0.08   0.01   0.23    -0.05  -0.00  -0.13     0.13   0.01   0.35
    23   1     0.13  -0.20   0.02    -0.09   0.10  -0.01     0.22  -0.31   0.04
    24   1     0.09  -0.01   0.24    -0.01   0.00  -0.03     0.15  -0.02   0.43
    25   1     0.14   0.20   0.02    -0.01  -0.03  -0.01     0.29   0.37   0.04
    26   1    -0.05   0.10   0.29    -0.08   0.14   0.41     0.01  -0.02  -0.09
    27   1     0.14   0.28   0.02     0.19   0.41   0.03    -0.04  -0.09  -0.01
    28   6     0.00  -0.00  -0.00    -0.01   0.00   0.00    -0.00   0.00   0.00
    29   7     0.01   0.01  -0.03    -0.01  -0.01   0.02    -0.01  -0.01   0.02
    30   1     0.09   0.03   0.29     0.08   0.04   0.26    -0.04  -0.02  -0.11
    31   1    -0.25   0.09   0.15    -0.23   0.08   0.14     0.09  -0.04  -0.06
    32   1     0.00  -0.00  -0.01    -0.01  -0.02   0.02    -0.00   0.00   0.01
    33   1     0.00   0.02   0.01    -0.03   0.01  -0.01    -0.01  -0.00  -0.00
    34   1     0.00  -0.01   0.01     0.03   0.01   0.01     0.01   0.01   0.00
    35   1     0.00   0.00  -0.01     0.01  -0.02  -0.02     0.00  -0.01   0.00
    36   1     0.09  -0.03   0.28    -0.06   0.03  -0.20    -0.07   0.04  -0.24
    37   1    -0.25  -0.08   0.15     0.18   0.05  -0.11     0.21   0.07  -0.12
                     79                     80                     81
                      A                      A                      A
 Frequencies --   1658.5805              1668.9977              1671.3693
 Red. masses --      1.0784                 1.0770                 1.0763
 Frc consts  --      1.7478                 1.7676                 1.7714
 IR Inten    --      0.4562                29.4404                19.4499
 RamAct Fr= 1--      6.9284                 4.4299                 3.0660
  Dep-P Fr= 1--      0.7495                 0.7492                 0.7500
  Dep-U Fr= 1--      0.8568                 0.8566                 0.8571
 Alpha2 Fr= 1--      0.0001                 0.0001                 0.0000
 Beta2  Fr= 1--      0.9894                 0.6325                 0.4380
 AlphaG Fr= 1--      0.0036                -0.0009                 0.0000
 Gamma2 Fr= 1--    -14.8680                 5.8312                 4.5346
 Delta2 Fr= 1--     -6.4445                 0.9251                -0.0382
 Raman1 Fr= 1--      27.714                 17.720                 12.264
 ROA1   Fr= 1--   -1633.556                589.401                434.096
 CID1   Fr= 1--     -58.944                 33.262                 35.396
 Raman2 Fr= 1--      11.873                  7.590                  5.256
 ROA2   Fr= 1--    -305.277                132.549                109.135
 CID2   Fr= 1--     -25.713                 17.464                 20.764
 Raman3 Fr= 1--      23.745                 15.179                 10.512
 ROA3   Fr= 1--   -1633.556                589.401                434.096
 CID3   Fr= 1--     -68.795                 38.829                 41.296
 RC180  Fr= 1--       0.714                  0.713                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00   0.01    -0.00   0.00   0.00     0.00  -0.00   0.01
     2   6     0.00   0.00  -0.01    -0.00   0.00  -0.01     0.00  -0.00  -0.00
     3   7    -0.02   0.02  -0.02    -0.02   0.02  -0.03    -0.00   0.00  -0.00
     4  45    -0.00   0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
     5   7     0.02   0.01   0.02     0.02   0.02   0.02    -0.00  -0.00  -0.00
     6   6    -0.00   0.00   0.01     0.00   0.00   0.01     0.00  -0.00  -0.01
     7   6    -0.00  -0.00  -0.01     0.00   0.00  -0.00     0.00   0.00   0.01
     8   7    -0.00  -0.02  -0.01     0.00   0.01   0.01     0.00   0.03   0.02
     9   7     0.00  -0.02   0.01    -0.00   0.01  -0.01     0.00  -0.03   0.02
    10   7    -0.01   0.01   0.03     0.01  -0.01  -0.03     0.01  -0.01  -0.03
    11   6    -0.01  -0.00   0.01     0.01   0.00  -0.01     0.00   0.00  -0.01
    12   1    -0.01  -0.00   0.02     0.00  -0.01   0.00     0.01  -0.01  -0.02
    13   1     0.01   0.01   0.01     0.00   0.01   0.01    -0.01   0.00  -0.00
    14   1     0.00   0.02  -0.02    -0.02   0.00  -0.01    -0.01  -0.01   0.02
    15   1     0.00  -0.02  -0.02     0.00  -0.00  -0.00    -0.00   0.02   0.01
    16   1     0.00   0.02   0.03     0.02   0.01   0.01    -0.01   0.01   0.02
    17   1    -0.01  -0.02   0.02    -0.00  -0.00   0.00    -0.01  -0.02   0.01
    18   1     0.01  -0.00  -0.02     0.00  -0.01  -0.01     0.01   0.01  -0.02
    19   1    -0.01   0.01  -0.02    -0.01   0.01  -0.01    -0.01  -0.00  -0.00
    20   1     0.03   0.06  -0.23    -0.01  -0.03   0.10     0.06   0.10  -0.34
    21   1    -0.10   0.21  -0.02     0.04  -0.09   0.01    -0.14   0.33  -0.02
    22   1     0.09  -0.00   0.32     0.11  -0.00   0.38     0.00   0.00   0.01
    23   1     0.19  -0.28   0.03     0.23  -0.33   0.04     0.02   0.00  -0.00
    24   1    -0.06  -0.00  -0.26    -0.10  -0.00  -0.36     0.01  -0.00   0.02
    25   1    -0.16  -0.21  -0.03    -0.23  -0.30  -0.04     0.03   0.01   0.00
    26   1    -0.02   0.06   0.22     0.01  -0.04  -0.13     0.05  -0.10  -0.32
    27   1     0.10   0.20   0.01    -0.06  -0.12  -0.01    -0.14  -0.31  -0.02
    28   6     0.01  -0.00  -0.01    -0.01   0.00   0.01     0.00  -0.00  -0.01
    29   7     0.01   0.01  -0.03    -0.01  -0.01   0.03     0.01   0.01  -0.03
    30   1    -0.10  -0.02  -0.32     0.09   0.04   0.28     0.10   0.03   0.32
    31   1     0.27  -0.09  -0.16    -0.23   0.09   0.14    -0.28   0.10   0.17
    32   1     0.01   0.02  -0.01    -0.01  -0.02   0.01     0.01   0.00  -0.01
    33   1     0.02  -0.01   0.00    -0.02   0.01  -0.00     0.01   0.02   0.01
    34   1    -0.02  -0.01  -0.00     0.02   0.01   0.00     0.00  -0.02   0.01
    35   1    -0.01   0.02   0.01     0.00  -0.02  -0.01     0.01   0.00  -0.01
    36   1     0.09  -0.02   0.29    -0.08   0.04  -0.26     0.11  -0.03   0.35
    37   1    -0.25  -0.07   0.15     0.22   0.07  -0.14    -0.30  -0.09   0.18
                     82                     83                     84
                      A                      A                      A
 Frequencies --   3068.8507              3070.7181              3071.1920
 Red. masses --      1.0636                 1.0634                 1.0632
 Frc consts  --      5.9015                 5.9076                 5.9083
 IR Inten    --      5.4920                 5.5694                 5.5354
 RamAct Fr= 1--    249.0660               215.6360               234.9203
  Dep-P Fr= 1--      0.0357                 0.0410                 0.0383
  Dep-U Fr= 1--      0.0690                 0.0788                 0.0737
 Alpha2 Fr= 1--      5.0895                 4.3514                 4.7715
 Beta2  Fr= 1--      2.8628                 2.8320                 2.8861
 AlphaG Fr= 1--     -0.9666                 0.2780                 0.2810
 Gamma2 Fr= 1--     -5.3331                 7.4780                 3.9279
 Delta2 Fr= 1--     -1.6994                 7.1192                 4.9227
 Raman1 Fr= 1--     996.264                862.544                939.681
 ROA1   Fr= 1--    -566.357                945.704                534.600
 CID1   Fr= 1--      -0.568                  1.096                  0.569
 Raman2 Fr= 1--      34.354                 33.984                 34.634
 ROA2   Fr= 1--    -114.399                122.518                 54.887
 CID2   Fr= 1--      -3.330                  3.605                  1.585
 Raman3 Fr= 1--      68.707                 67.969                 69.267
 ROA3   Fr= 1--    -566.357                945.704                534.600
 CID3   Fr= 1--      -8.243                 13.914                  7.718
 RC180  Fr= 1--      -0.862                 -0.842                 -0.853
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00   0.00   0.00     0.00   0.00   0.00     0.01   0.03   0.03
     2   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.04  -0.01  -0.04
     3   7     0.00   0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00   0.00
     4  45     0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00  -0.00
     5   7    -0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00  -0.00
     6   6    -0.00  -0.00   0.00     0.04   0.01  -0.03    -0.00  -0.00   0.00
     7   6    -0.00   0.00  -0.00     0.01  -0.04   0.03    -0.00   0.00  -0.00
     8   7    -0.00   0.00   0.00     0.00   0.00  -0.00    -0.00   0.00   0.00
     9   7     0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.00  -0.00
    10   7     0.00   0.00   0.00    -0.00   0.00   0.00    -0.00  -0.00  -0.00
    11   6    -0.04  -0.03  -0.02    -0.00  -0.00  -0.00     0.00   0.00   0.00
    12   1     0.01   0.00   0.00    -0.36  -0.03  -0.12     0.00   0.00   0.00
    13   1    -0.01  -0.01   0.01     0.28   0.45  -0.27    -0.00  -0.01   0.00
    14   1     0.00  -0.01  -0.00    -0.13   0.33   0.10     0.00  -0.01  -0.00
    15   1     0.01   0.01  -0.01    -0.29  -0.44   0.27     0.01   0.01  -0.01
    16   1    -0.00  -0.01   0.00    -0.00  -0.01   0.00    -0.17  -0.36   0.12
    17   1    -0.01   0.01   0.01    -0.01   0.01   0.00    -0.29   0.49   0.29
    18   1    -0.00   0.00  -0.00    -0.01   0.00  -0.00    -0.32   0.04  -0.11
    19   1     0.00  -0.01  -0.00     0.00  -0.01  -0.01     0.23  -0.42  -0.25
    20   1    -0.00  -0.00  -0.00    -0.00   0.00  -0.00    -0.01   0.01  -0.00
    21   1    -0.00   0.00   0.00    -0.00   0.00  -0.00     0.00   0.00   0.00
    22   1    -0.00  -0.00   0.00     0.00  -0.00  -0.00     0.00  -0.01   0.00
    23   1     0.00   0.00  -0.00     0.00   0.00   0.00     0.01  -0.00  -0.00
    24   1     0.00  -0.00  -0.00     0.00   0.01   0.00     0.00   0.00  -0.00
    25   1    -0.00   0.00   0.00     0.00   0.00  -0.00     0.00  -0.00   0.00
    26   1     0.00  -0.00   0.00    -0.01  -0.01  -0.00     0.00   0.00   0.00
    27   1     0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00  -0.00  -0.00
    28   6     0.04  -0.02   0.01     0.00  -0.00   0.00     0.00  -0.00  -0.00
    29   7    -0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
    30   1    -0.00  -0.00  -0.00     0.00  -0.00   0.00     0.00   0.00   0.00
    31   1    -0.00   0.00  -0.01    -0.00   0.00  -0.00     0.00  -0.00   0.00
    32   1     0.46  -0.00   0.43     0.00   0.00   0.00    -0.02   0.00  -0.01
    33   1     0.04   0.30  -0.24     0.00   0.00  -0.00    -0.00  -0.01   0.01
    34   1    -0.02   0.26   0.21    -0.00   0.01   0.01    -0.00   0.00   0.00
    35   1    -0.42   0.02  -0.39    -0.02   0.00  -0.02    -0.00   0.00  -0.00
    36   1     0.00  -0.00   0.00     0.00  -0.00   0.00     0.00   0.00   0.00
    37   1     0.00   0.00   0.01     0.00   0.00   0.00    -0.00  -0.00  -0.00
                     85                     86                     87
                      A                      A                      A
 Frequencies --   3074.6836              3075.9126              3076.3064
 Red. masses --      1.0604                 1.0604                 1.0604
 Frc consts  --      5.9062                 5.9112                 5.9126
 IR Inten    --      8.4237                 7.5395                 9.6992
 RamAct Fr= 1--     45.6616                41.0940                61.6332
  Dep-P Fr= 1--      0.7356                 0.7484                 0.6999
  Dep-U Fr= 1--      0.8476                 0.8561                 0.8234
 Alpha2 Fr= 1--      0.0112                 0.0011                 0.0539
 Beta2  Fr= 1--      6.4508                 5.8632                 8.4584
 AlphaG Fr= 1--     -0.0023                 0.0006                -0.0046
 Gamma2 Fr= 1--      8.6477                -5.4055                -7.0652
 Delta2 Fr= 1--      6.3816                -5.3424                -6.6960
 Raman1 Fr= 1--     182.646                164.376                246.533
 ROA1   Fr= 1--    1034.386               -689.886               -892.532
 CID1   Fr= 1--       5.663                 -4.197                 -3.620
 Raman2 Fr= 1--      77.410                 70.359                101.501
 ROA2   Fr= 1--     156.492                -86.993               -115.996
 CID2   Fr= 1--       2.022                 -1.236                 -1.143
 Raman3 Fr= 1--     154.820                140.718                203.001
 ROA3   Fr= 1--    1034.386               -689.886               -892.532
 CID3   Fr= 1--       6.681                 -4.903                 -4.397
 RC180  Fr= 1--       0.695                  0.712                  0.647
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00  -0.00  -0.00    -0.00  -0.01  -0.01    -0.02  -0.03  -0.04
     2   6    -0.00   0.00   0.00     0.01   0.00  -0.01     0.03   0.01  -0.03
     3   7    -0.00  -0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
     4  45     0.00   0.00   0.00     0.00   0.00  -0.00     0.00  -0.00  -0.00
     5   7    -0.00   0.00   0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
     6   6    -0.00  -0.00   0.00     0.04  -0.01  -0.03    -0.01   0.00   0.01
     7   6    -0.00   0.00  -0.00    -0.02   0.03  -0.03     0.00  -0.01   0.01
     8   7     0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
     9   7     0.00   0.00  -0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
    10   7    -0.00   0.00   0.00    -0.00   0.00   0.00     0.00  -0.00   0.00
    11   6     0.03   0.03   0.00    -0.00  -0.00  -0.00     0.00  -0.00   0.00
    12   1     0.01   0.00   0.00     0.48   0.03   0.15    -0.09  -0.01  -0.03
    13   1    -0.01  -0.01   0.01    -0.22  -0.36   0.22     0.04   0.07  -0.04
    14   1     0.00  -0.00  -0.00    -0.19   0.44   0.14     0.03  -0.08  -0.02
    15   1     0.00   0.00  -0.00    -0.24  -0.37   0.23     0.04   0.07  -0.04
    16   1     0.00   0.01  -0.00    -0.03  -0.07   0.02    -0.19  -0.39   0.12
    17   1     0.01  -0.01  -0.01    -0.04   0.06   0.04    -0.19   0.33   0.20
    18   1     0.01  -0.00   0.00     0.09  -0.01   0.03     0.52  -0.05   0.17
    19   1    -0.01   0.01   0.01    -0.04   0.07   0.04    -0.23   0.40   0.24
    20   1    -0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.01  -0.00  -0.00
    21   1    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00  -0.00  -0.01
    22   1    -0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00  -0.00
    23   1    -0.00   0.00   0.00     0.00  -0.00  -0.00     0.00  -0.00  -0.00
    24   1    -0.00  -0.00  -0.00    -0.00   0.01  -0.00    -0.00  -0.00   0.00
    25   1    -0.00  -0.00  -0.00     0.00   0.00  -0.01    -0.00  -0.00   0.00
    26   1    -0.00   0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    27   1    -0.00   0.00  -0.00    -0.00   0.00  -0.01     0.00  -0.00   0.00
    28   6     0.04  -0.04   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
    29   7    -0.00  -0.00   0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    30   1     0.01   0.00   0.00     0.00  -0.00   0.00    -0.00   0.00  -0.00
    31   1     0.00  -0.00   0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
    32   1    -0.35   0.00  -0.32     0.01  -0.00   0.01    -0.00   0.00  -0.00
    33   1    -0.05  -0.37   0.29     0.00   0.01  -0.00    -0.00   0.00  -0.00
    34   1    -0.03   0.40   0.32     0.00  -0.00  -0.00     0.00  -0.00  -0.00
    35   1    -0.39   0.01  -0.36     0.00  -0.00   0.00     0.00  -0.00   0.00
    36   1     0.01  -0.00   0.00    -0.00   0.00   0.00     0.00   0.00   0.00
    37   1     0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00  -0.00   0.00
                     88                     89                     90
                      A                      A                      A
 Frequencies --   3115.5617              3116.3029              3116.5435
 Red. masses --      1.1071                 1.1076                 1.1078
 Frc consts  --      6.3315                 6.3376                 6.3394
 IR Inten    --      8.9964                10.0790                 4.5510
 RamAct Fr= 1--    167.3187               151.9008               177.1676
  Dep-P Fr= 1--      0.4340                 0.5806                 0.2273
  Dep-U Fr= 1--      0.6053                 0.7347                 0.3704
 Alpha2 Fr= 1--      1.0925                 0.4824                 2.2355
 Beta2  Fr= 1--     16.8793                18.5991                10.9386
 AlphaG Fr= 1--      0.0867                -0.2511                -1.2067
 Gamma2 Fr= 1--    -31.9884                -6.5240                65.3384
 Delta2 Fr= 1--    -23.4638               -23.5259                36.9881
 Raman1 Fr= 1--     669.275                607.603                708.671
 ROA1   Fr= 1--   -3821.734              -1379.136               7456.103
 CID1   Fr= 1--      -5.710                 -2.270                 10.521
 Raman2 Fr= 1--     202.552                223.189                131.263
 ROA2   Fr= 1--    -580.012                 31.630               1272.215
 CID2   Fr= 1--      -2.864                  0.142                  9.692
 Raman3 Fr= 1--     405.103                446.377                262.527
 ROA3   Fr= 1--   -3821.734              -1379.136               7456.103
 CID3   Fr= 1--      -9.434                 -3.090                 28.401
 RC180  Fr= 1--       0.211                  0.469                 -0.259
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00    -0.02   0.01  -0.00    -0.06   0.03  -0.00
     2   6    -0.00  -0.00  -0.00    -0.00  -0.02   0.00    -0.01  -0.06   0.00
     3   7     0.00   0.00   0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
     4  45     0.00   0.00   0.00     0.00  -0.00   0.00     0.00   0.00   0.00
     5   7    -0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
     6   6     0.00  -0.00  -0.00    -0.00   0.06   0.00     0.00  -0.02  -0.00
     7   6     0.00   0.00   0.00    -0.06  -0.02  -0.00     0.02   0.01   0.00
     8   7    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     9   7     0.00  -0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.00  -0.00
    10   7    -0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
    11   6     0.02  -0.04   0.05     0.00  -0.00   0.00    -0.00   0.00  -0.00
    12   1    -0.03  -0.00  -0.01     0.52   0.02   0.18    -0.20  -0.01  -0.07
    13   1    -0.01  -0.02   0.01     0.16   0.26  -0.17    -0.06  -0.10   0.06
    14   1    -0.01   0.03   0.01     0.22  -0.49  -0.17    -0.08   0.19   0.07
    15   1     0.01   0.02  -0.01    -0.17  -0.25   0.16     0.06   0.09  -0.06
    16   1     0.01   0.02  -0.01     0.09   0.19  -0.07     0.25   0.49  -0.17
    17   1    -0.01   0.01   0.01    -0.06   0.10   0.06    -0.16   0.26   0.17
    18   1     0.03  -0.00   0.01     0.19  -0.02   0.07     0.50  -0.04   0.18
    19   1     0.01  -0.01  -0.01     0.06  -0.10  -0.06     0.14  -0.27  -0.16
    20   1     0.00   0.00   0.00    -0.00   0.00   0.00    -0.01   0.01   0.00
    21   1     0.00   0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    22   1    -0.00  -0.00  -0.00     0.00  -0.01  -0.00     0.00  -0.02  -0.00
    23   1     0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
    24   1    -0.00  -0.00   0.00     0.00   0.01  -0.00    -0.00  -0.01   0.00
    25   1    -0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
    26   1    -0.00   0.00  -0.00    -0.01  -0.01   0.00     0.00   0.00  -0.00
    27   1    -0.00   0.00  -0.00     0.00  -0.00   0.00    -0.00   0.00   0.00
    28   6    -0.02  -0.04  -0.05    -0.00  -0.00  -0.00     0.00   0.00   0.00
    29   7     0.00   0.00   0.00     0.00  -0.00   0.00    -0.00  -0.00  -0.00
    30   1     0.00   0.00  -0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
    31   1     0.01  -0.01   0.01     0.00  -0.00   0.00    -0.00   0.00  -0.00
    32   1    -0.27  -0.00  -0.24    -0.01  -0.00  -0.01     0.02   0.00   0.02
    33   1     0.08   0.48  -0.37     0.00   0.02  -0.02    -0.01  -0.03   0.03
    34   1    -0.06   0.47   0.36    -0.00   0.02   0.01     0.00  -0.03  -0.02
    35   1     0.26  -0.02   0.23     0.01  -0.00   0.01    -0.02   0.00  -0.02
    36   1    -0.00   0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    37   1    -0.01  -0.00  -0.01    -0.00  -0.00  -0.00     0.00   0.00   0.00
                     91                     92                     93
                      A                      A                      A
 Frequencies --   3125.5685              3126.8136              3127.1841
 Red. masses --      1.1102                 1.1101                 1.1101
 Frc consts  --      6.3901                 6.3949                 6.3960
 IR Inten    --      4.5984                 2.6386                 3.6640
 RamAct Fr= 1--     56.1302                62.3694                51.0137
  Dep-P Fr= 1--      0.7500                 0.7500                 0.7500
  Dep-U Fr= 1--      0.8571                 0.8571                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0000
 Beta2  Fr= 1--      8.0184                 8.9097                 7.2877
 AlphaG Fr= 1--      0.0000                 0.0005                -0.0000
 Gamma2 Fr= 1--     34.6325               -40.9730               -33.7297
 Delta2 Fr= 1--      5.0059                -4.8402                -3.8479
 Raman1 Fr= 1--     224.521                249.478                204.055
 ROA1   Fr= 1--    3484.908              -4088.290              -3361.187
 CID1   Fr= 1--      15.522                -16.387                -16.472
 Raman2 Fr= 1--      96.221                106.917                 87.452
 ROA2   Fr= 1--     791.132               -944.630               -778.730
 CID2   Fr= 1--       8.222                 -8.835                 -8.905
 Raman3 Fr= 1--     192.442                213.833                174.904
 ROA3   Fr= 1--    3484.908              -4088.290              -3361.187
 CID3   Fr= 1--      18.109                -19.119                -19.217
 RC180  Fr= 1--       0.714                  0.714                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00   0.00     0.01  -0.00  -0.00    -0.06   0.04   0.01
     2   6    -0.00   0.00   0.00     0.00  -0.01  -0.00    -0.00   0.07   0.01
     3   7    -0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00  -0.00
     4  45    -0.00   0.00  -0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
     5   7    -0.00   0.00   0.00     0.00   0.00  -0.00    -0.00   0.00  -0.00
     6   6    -0.00  -0.00   0.00    -0.01  -0.07   0.01    -0.00  -0.01   0.00
     7   6    -0.00  -0.00   0.00    -0.06  -0.03   0.01    -0.00  -0.00   0.00
     8   7     0.00   0.00   0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     9   7    -0.00  -0.00   0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
    10   7     0.00  -0.00   0.00    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    11   6    -0.02   0.03  -0.05     0.00  -0.00   0.00     0.00  -0.00   0.00
    12   1     0.02   0.00   0.01     0.46   0.02   0.16     0.04   0.00   0.01
    13   1     0.01   0.01  -0.01     0.23   0.38  -0.24     0.02   0.03  -0.02
    14   1    -0.01   0.02   0.01    -0.19   0.43   0.15    -0.02   0.04   0.01
    15   1     0.01   0.01  -0.01     0.24   0.36  -0.24     0.02   0.03  -0.02
    16   1    -0.01  -0.01   0.00     0.02   0.03  -0.01    -0.20  -0.41   0.14
    17   1     0.01  -0.01  -0.01    -0.02   0.03   0.02     0.22  -0.36  -0.23
    18   1     0.01  -0.00   0.00    -0.04   0.00  -0.01     0.46  -0.04   0.16
    19   1     0.01  -0.01  -0.01    -0.02   0.04   0.02     0.22  -0.41  -0.25
    20   1     0.00   0.00   0.00     0.00  -0.00  -0.00    -0.01   0.01   0.01
    21   1     0.00   0.00   0.00    -0.00   0.00   0.00     0.00  -0.00   0.00
    22   1     0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00   0.02   0.01
    23   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    24   1     0.00  -0.00   0.00    -0.00  -0.02   0.01     0.00  -0.00   0.00
    25   1    -0.00   0.00   0.00    -0.00   0.00   0.00     0.00  -0.00   0.00
    26   1     0.00  -0.00   0.00    -0.01  -0.01   0.01    -0.00  -0.00   0.00
    27   1     0.00  -0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    28   6    -0.03  -0.03  -0.06     0.00   0.00   0.00     0.00   0.00   0.00
    29   7     0.00   0.00   0.00    -0.00   0.00  -0.00     0.00   0.00  -0.00
    30   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00   0.00  -0.00
    31   1    -0.01   0.01  -0.01     0.00  -0.00   0.00     0.00  -0.00   0.00
    32   1     0.36   0.00   0.32    -0.01  -0.00  -0.01    -0.01  -0.00  -0.01
    33   1    -0.07  -0.39   0.30     0.00   0.01  -0.01     0.00   0.01  -0.01
    34   1    -0.05   0.40   0.31     0.00  -0.01  -0.01     0.00  -0.01  -0.01
    35   1     0.37  -0.02   0.33    -0.01   0.00  -0.01    -0.01   0.00  -0.01
    36   1    -0.00   0.00   0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
    37   1    -0.01  -0.01  -0.01     0.00   0.00   0.00     0.00   0.00   0.00
                     94                     95                     96
                      A                      A                      A
 Frequencies --   3430.7968              3431.9090              3432.9512
 Red. masses --      1.0521                 1.0524                 1.0525
 Frc consts  --      7.2965                 7.3032                 7.3084
 IR Inten    --     57.2342                43.1794                29.0205
 RamAct Fr= 1--      6.9360                40.0709                34.3090
  Dep-P Fr= 1--      0.7108                 0.2040                 0.1007
  Dep-U Fr= 1--      0.8309                 0.3388                 0.1830
 Alpha2 Fr= 1--      0.0047                 0.5385                 0.5997
 Beta2  Fr= 1--      0.9606                 2.2629                 1.0463
 AlphaG Fr= 1--      0.0010                 0.1313                 0.6460
 Gamma2 Fr= 1--      9.3790                 4.0833                 5.7541
 Delta2 Fr= 1--     -0.9784                 3.5151                -2.7733
 Raman1 Fr= 1--      27.744                160.284                137.236
 ROA1   Fr= 1--     869.079                504.479                463.650
 CID1   Fr= 1--      31.325                  3.147                  3.378
 Raman2 Fr= 1--      11.527                 27.155                 12.555
 ROA2   Fr= 1--     232.924                 69.878                160.286
 CID2   Fr= 1--      20.207                  2.573                 12.766
 Raman3 Fr= 1--      23.054                 54.311                 25.111
 ROA3   Fr= 1--     869.079                504.479                463.650
 CID3   Fr= 1--      37.698                  9.289                 18.464
 RC180  Fr= 1--       0.662                 -0.322                 -0.634
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
     2   6     0.00  -0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
     3   7     0.00  -0.00   0.01    -0.01   0.02  -0.02     0.01  -0.02   0.02
     4  45    -0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00  -0.00
     5   7     0.00   0.00   0.00     0.01   0.01   0.02    -0.00  -0.01  -0.01
     6   6     0.00   0.00  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
     7   6    -0.00  -0.00  -0.00     0.00   0.00   0.00     0.00   0.00   0.00
     8   7    -0.02  -0.03  -0.03     0.01   0.02   0.02     0.01   0.02   0.01
     9   7    -0.01   0.03  -0.02    -0.01   0.02  -0.02    -0.01   0.01  -0.01
    10   7    -0.00   0.00   0.00     0.00  -0.00  -0.01    -0.01   0.00   0.03
    11   6     0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
    12   1     0.01   0.00   0.00    -0.01  -0.00  -0.00    -0.00  -0.00  -0.00
    13   1     0.00   0.01  -0.00    -0.00  -0.01   0.00    -0.00  -0.00   0.00
    14   1    -0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
    15   1    -0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    16   1    -0.00   0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
    17   1    -0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00   0.01   0.00
    18   1     0.01  -0.00   0.00     0.01  -0.00   0.00     0.00  -0.00   0.00
    19   1     0.00  -0.01  -0.00     0.00  -0.01  -0.00     0.00  -0.00  -0.00
    20   1     0.27  -0.38  -0.10     0.25  -0.35  -0.09     0.13  -0.18  -0.05
    21   1    -0.09   0.02   0.44    -0.08   0.02   0.41    -0.04   0.01   0.21
    22   1    -0.03   0.08   0.01     0.12  -0.27  -0.05    -0.16   0.39   0.07
    23   1    -0.00  -0.02  -0.08     0.01   0.06   0.28    -0.01  -0.08  -0.37
    24   1    -0.03  -0.06   0.01    -0.12  -0.25   0.05     0.05   0.10  -0.02
    25   1    -0.00   0.01  -0.06    -0.01   0.06  -0.26     0.00  -0.02   0.09
    26   1     0.32   0.42  -0.11    -0.23  -0.29   0.08    -0.17  -0.22   0.06
    27   1    -0.10  -0.02   0.49     0.07   0.01  -0.35     0.05   0.01  -0.25
    28   6     0.00   0.00   0.00     0.00   0.00   0.00    -0.00  -0.00  -0.00
    29   7    -0.00  -0.00   0.00    -0.00  -0.00   0.01     0.00   0.00  -0.02
    30   1     0.03  -0.00  -0.01    -0.07   0.01   0.02     0.36  -0.06  -0.08
    31   1    -0.02   0.00  -0.03     0.04  -0.01   0.07    -0.23   0.05  -0.37
    32   1    -0.00  -0.00  -0.00     0.00   0.00   0.00    -0.01  -0.00  -0.01
    33   1    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00   0.00  -0.00
    34   1    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00     0.00   0.00   0.00
    35   1    -0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
    36   1     0.03   0.00  -0.01     0.08   0.01  -0.02    -0.17  -0.02   0.04
    37   1    -0.02  -0.00  -0.03    -0.05  -0.01  -0.08     0.11   0.02   0.17
                     97                     98                     99
                      A                      A                      A
 Frequencies --   3433.1145              3433.9272              3434.9751
 Red. masses --      1.0525                 1.0528                 1.0527
 Frc consts  --      7.3087                 7.3146                 7.3180
 IR Inten    --    113.8432                10.1638                 0.2106
 RamAct Fr= 1--      4.1072                22.4566               434.1951
  Dep-P Fr= 1--      0.1570                 0.7199                 0.0099
  Dep-U Fr= 1--      0.2714                 0.8371                 0.0196
 Alpha2 Fr= 1--      0.0624                 0.0117                 9.4286
 Beta2  Fr= 1--      0.1858                 3.1332                 1.4154
 AlphaG Fr= 1--      0.0828                -0.0022                 0.5459
 Gamma2 Fr= 1--      1.5986                -5.2684               -15.7617
 Delta2 Fr= 1--     -0.4781                -0.2526                -1.5854
 Raman1 Fr= 1--      16.429                 89.826               1736.781
 ROA1   Fr= 1--     138.165               -513.850              -1563.859
 CID1   Fr= 1--       8.410                 -5.720                 -0.900
 Raman2 Fr= 1--       2.229                 37.598                 16.985
 ROA2   Fr= 1--      42.192               -124.422               -365.599
 CID2   Fr= 1--      18.926                 -3.309                -21.525
 Raman3 Fr= 1--       4.458                 75.196                 33.969
 ROA3   Fr= 1--     138.165               -513.850              -1563.859
 CID3   Fr= 1--      30.989                 -6.833                -46.038
 RC180  Fr= 1--      -0.457                  0.674                 -0.961
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
     2   6    -0.00   0.00   0.00    -0.00  -0.00   0.00    -0.00   0.00  -0.00
     3   7    -0.01   0.01  -0.01     0.01  -0.02   0.02    -0.01   0.02  -0.02
     4  45     0.00  -0.00   0.00    -0.00   0.00   0.00    -0.00  -0.00  -0.00
     5   7    -0.02  -0.02  -0.02     0.01   0.02   0.02     0.01   0.02   0.02
     6   6    -0.00  -0.00   0.00    -0.00   0.00   0.00     0.00   0.00   0.00
     7   6     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00  -0.00
     8   7     0.00   0.00   0.00     0.00   0.00   0.00    -0.00  -0.01  -0.01
     9   7    -0.00   0.01  -0.01     0.00  -0.00   0.00     0.00  -0.01   0.01
    10   7     0.00  -0.00  -0.01     0.01  -0.00  -0.03    -0.01   0.00   0.03
    11   6    -0.00   0.00  -0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
    12   1     0.00   0.00   0.00    -0.00  -0.00  -0.00     0.00   0.00   0.00
    13   1    -0.00  -0.00   0.00     0.00   0.00  -0.00     0.00   0.00  -0.00
    14   1    -0.00   0.01   0.00     0.00  -0.00  -0.00     0.00  -0.01  -0.00
    15   1     0.01   0.01  -0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
    16   1    -0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    17   1     0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
    18   1     0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00  -0.00
    19   1     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
    20   1     0.10  -0.14  -0.03    -0.01   0.02   0.00    -0.09   0.13   0.03
    21   1    -0.03   0.01   0.15     0.00  -0.00  -0.02     0.03  -0.01  -0.13
    22   1     0.10  -0.23  -0.04    -0.13   0.30   0.06     0.12  -0.28  -0.05
    23   1     0.01   0.05   0.22    -0.01  -0.06  -0.29     0.01   0.06   0.26
    24   1     0.20   0.42  -0.08    -0.14  -0.30   0.06    -0.15  -0.30   0.06
    25   1     0.01  -0.09   0.41    -0.01   0.07  -0.30    -0.01   0.06  -0.29
    26   1    -0.01  -0.01   0.00    -0.02  -0.02   0.01     0.09   0.12  -0.03
    27   1     0.00   0.00  -0.02     0.01   0.00  -0.02    -0.03  -0.00   0.12
    28   6    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    29   7     0.01   0.00  -0.03     0.01   0.00  -0.03     0.01   0.00  -0.03
    30   1    -0.15   0.02   0.04    -0.36   0.06   0.08     0.32  -0.05  -0.07
    31   1     0.10  -0.02   0.15     0.24  -0.05   0.37    -0.21   0.04  -0.32
    32   1     0.00   0.00   0.00     0.00   0.00   0.01    -0.00  -0.00  -0.01
    33   1    -0.00  -0.00   0.00    -0.00  -0.00   0.01     0.00   0.00  -0.00
    34   1    -0.00   0.00   0.00    -0.00   0.00   0.00     0.00   0.00   0.00
    35   1     0.00  -0.00   0.01     0.00  -0.00   0.00     0.00  -0.00   0.01
    36   1    -0.38  -0.04   0.09    -0.32  -0.04   0.07    -0.34  -0.04   0.08
    37   1     0.25   0.04   0.38     0.21   0.03   0.32     0.22   0.03   0.34
                    100                    101                    102
                      A                      A                      A
 Frequencies --   3480.6677              3480.9021              3481.4934
 Red. masses --      1.0931                 1.0930                 1.0929
 Frc consts  --      7.8024                 7.8026                 7.8049
 IR Inten    --      3.8485                27.7264                86.2970
 RamAct Fr= 1--     10.7900                 6.2178                 2.6974
  Dep-P Fr= 1--      0.7491                 0.6903                 0.6828
  Dep-U Fr= 1--      0.8566                 0.8168                 0.8115
 Alpha2 Fr= 1--      0.0002                 0.0065                 0.0032
 Beta2  Fr= 1--      1.5404                 0.8464                 0.3648
 AlphaG Fr= 1--     -0.0003                -0.0256                -0.0058
 Gamma2 Fr= 1--    -11.2412                 3.2583                -2.4708
 Delta2 Fr= 1--      6.6801                 2.3533                -1.1967
 Raman1 Fr= 1--      43.160                 24.871                 10.790
 ROA1   Fr= 1--    -865.391                388.099               -275.493
 CID1   Fr= 1--     -20.051                 15.604                -25.533
 Raman2 Fr= 1--      18.485                 10.157                  4.378
 ROA2   Fr= 1--    -323.229                 59.373                -49.726
 CID2   Fr= 1--     -17.486                  5.845                -11.359
 Raman3 Fr= 1--      36.970                 20.314                  8.756
 ROA3   Fr= 1--    -865.391                388.099               -275.493
 CID3   Fr= 1--     -23.408                 19.105                -31.465
 RC180  Fr= 1--       0.713                  0.634                  0.623
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
     2   6     0.00  -0.00  -0.00     0.00  -0.00   0.00    -0.00   0.00   0.00
     3   7     0.01  -0.03  -0.04     0.00  -0.01  -0.01    -0.01   0.02   0.03
     4  45     0.00   0.00   0.00    -0.00   0.00   0.00     0.00   0.00  -0.00
     5   7     0.01   0.02  -0.02    -0.01  -0.03   0.03    -0.01  -0.02   0.02
     6   6     0.00   0.00  -0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
     7   6    -0.00  -0.00   0.00    -0.00  -0.00   0.00    -0.00  -0.00   0.00
     8   7    -0.02  -0.02   0.04    -0.02  -0.02   0.03    -0.02  -0.02   0.03
     9   7    -0.01   0.01   0.02     0.03  -0.03  -0.04    -0.01   0.01   0.02
    10   7    -0.00   0.00  -0.00     0.00  -0.00   0.00    -0.03   0.00  -0.01
    11   6    -0.00   0.00  -0.00     0.00   0.00   0.00    -0.00   0.00  -0.00
    12   1     0.00   0.00   0.00     0.00   0.00   0.00     0.00   0.00   0.00
    13   1     0.01   0.01  -0.01     0.00   0.01  -0.00     0.00   0.01  -0.00
    14   1     0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
    15   1    -0.00  -0.01   0.00     0.01   0.01  -0.01     0.00   0.01  -0.00
    16   1     0.00   0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
    17   1    -0.01   0.01   0.01    -0.00   0.00   0.00     0.00  -0.01  -0.00
    18   1     0.00  -0.00   0.00    -0.00   0.00  -0.00     0.00  -0.00   0.00
    19   1     0.00  -0.01  -0.00    -0.01   0.01   0.01     0.00  -0.00  -0.00
    20   1     0.12  -0.17  -0.03    -0.29   0.40   0.08     0.11  -0.16  -0.03
    21   1     0.04  -0.00  -0.21    -0.09   0.01   0.52     0.04  -0.00  -0.22
    22   1    -0.16   0.39   0.05    -0.06   0.15   0.02     0.12  -0.28  -0.04
    23   1     0.02   0.08   0.46     0.01   0.03   0.16    -0.02  -0.06  -0.33
    24   1    -0.11  -0.22   0.03     0.14   0.30  -0.04     0.09   0.19  -0.03
    25   1     0.01  -0.05   0.27    -0.01   0.06  -0.35    -0.01   0.04  -0.24
    26   1     0.25   0.32  -0.06     0.17   0.22  -0.04     0.18   0.23  -0.05
    27   1     0.07   0.00  -0.44     0.05   0.00  -0.30     0.06   0.00  -0.33
    28   6    -0.00  -0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00  -0.00
    29   7    -0.00  -0.00  -0.00     0.00   0.00   0.00    -0.04  -0.01  -0.01
    30   1     0.04  -0.01  -0.01    -0.04   0.01   0.01     0.26  -0.04  -0.07
    31   1     0.02  -0.00   0.03    -0.02   0.00  -0.03     0.11  -0.03   0.20
    32   1     0.00  -0.00   0.00    -0.00  -0.00  -0.00     0.01   0.00   0.00
    33   1    -0.00  -0.00  -0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
    34   1    -0.00   0.00   0.00     0.00  -0.00   0.00     0.00   0.00   0.00
    35   1     0.00   0.00   0.00    -0.00  -0.00   0.00     0.01  -0.00   0.01
    36   1     0.04   0.00  -0.01    -0.01  -0.00   0.00     0.38   0.04  -0.11
    37   1     0.02   0.00   0.03    -0.01  -0.00  -0.01     0.17   0.03   0.29
                    103                    104                    105
                      A                      A                      A
 Frequencies --   3481.9790              3482.5007              3482.6205
 Red. masses --      1.0926                 1.0926                 1.0926
 Frc consts  --      7.8051                 7.8068                 7.8075
 IR Inten    --      2.4113                33.8471                48.2990
 RamAct Fr= 1--     39.4793                65.1245                47.5384
  Dep-P Fr= 1--      0.6114                 0.7495                 0.7492
  Dep-U Fr= 1--      0.7589                 0.8568                 0.8566
 Alpha2 Fr= 1--      0.1006                 0.0005                 0.0006
 Beta2  Fr= 1--      4.9932                 9.3002                 6.7870
 AlphaG Fr= 1--     -0.0139                -0.0360                -0.0344
 Gamma2 Fr= 1--    -80.3144                56.2327                39.8150
 Delta2 Fr= 1--    -22.1334                 7.0355                 4.0131
 Raman1 Fr= 1--     157.917                260.498                190.153
 ROA1   Fr= 1--   -8418.454               5623.473               3950.661
 CID1   Fr= 1--     -53.309                 21.587                 20.776
 Raman2 Fr= 1--      59.918                111.602                 81.444
 ROA2   Fr= 1--   -1750.478               1293.301                923.456
 CID2   Fr= 1--     -29.215                 11.589                 11.339
 Raman3 Fr= 1--     119.836                223.204                162.888
 ROA3   Fr= 1--   -8418.454               5623.473               3950.661
 CID3   Fr= 1--     -70.250                 25.194                 24.254
 RC180  Fr= 1--       0.518                  0.714                  0.713
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00   0.00     0.00   0.00   0.00     0.00  -0.00  -0.00
     2   6     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.00   0.00
     3   7     0.00  -0.01  -0.02     0.01  -0.03  -0.03    -0.00   0.00   0.00
     4  45     0.00  -0.00  -0.00     0.00   0.00   0.00     0.00  -0.00   0.00
     5   7    -0.01  -0.02   0.03    -0.00  -0.01   0.01     0.01   0.03  -0.03
     6   6    -0.00  -0.00   0.00    -0.00  -0.00   0.00     0.00   0.00  -0.00
     7   6     0.00   0.00  -0.00     0.00   0.00  -0.00     0.00   0.00   0.00
     8   7     0.01   0.01  -0.01     0.02   0.02  -0.03     0.00   0.00  -0.00
     9   7    -0.01   0.01   0.02    -0.00  -0.00   0.00     0.02  -0.02  -0.03
    10   7    -0.05   0.01  -0.02    -0.00   0.00  -0.00    -0.05   0.01  -0.02
    11   6    -0.00   0.00  -0.00     0.00  -0.00  -0.00    -0.00   0.00  -0.00
    12   1    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00     0.00  -0.00  -0.00
    13   1    -0.00  -0.00   0.00    -0.00  -0.01   0.00    -0.00  -0.00   0.00
    14   1    -0.00   0.00   0.00    -0.00   0.00   0.00     0.00  -0.00  -0.00
    15   1     0.00   0.01  -0.00     0.00   0.00  -0.00    -0.01  -0.01   0.01
    16   1     0.00   0.00  -0.00     0.00   0.00  -0.00    -0.00  -0.00   0.00
    17   1    -0.00   0.00   0.00    -0.01   0.01   0.00     0.00  -0.00  -0.00
    18   1     0.00  -0.00   0.00     0.00   0.00  -0.00    -0.00   0.00  -0.00
    19   1     0.00  -0.00  -0.00    -0.00   0.00   0.00    -0.00   0.01   0.00
    20   1     0.09  -0.13  -0.03     0.00   0.00   0.00    -0.18   0.26   0.05
    21   1     0.03  -0.00  -0.18     0.00  -0.00  -0.01    -0.06   0.00   0.35
    22   1    -0.07   0.17   0.02    -0.13   0.30   0.04     0.02  -0.05  -0.01
    23   1     0.01   0.04   0.21     0.02   0.06   0.37    -0.00  -0.01  -0.06
    24   1     0.12   0.26  -0.04     0.06   0.12  -0.02    -0.15  -0.31   0.04
    25   1    -0.01   0.05  -0.32    -0.01   0.02  -0.14     0.02  -0.07   0.40
    26   1    -0.07  -0.09   0.02    -0.19  -0.24   0.05    -0.03  -0.04   0.01
    27   1    -0.02  -0.00   0.12    -0.06  -0.00   0.34    -0.01   0.00   0.05
    28   6     0.00   0.00   0.00    -0.00  -0.00  -0.00    -0.00   0.00  -0.00
    29   7     0.04   0.00   0.01    -0.05  -0.01  -0.02    -0.01  -0.00  -0.00
    30   1     0.47  -0.07  -0.13     0.03  -0.00  -0.01     0.48  -0.07  -0.14
    31   1     0.20  -0.05   0.35     0.01  -0.00   0.02     0.21  -0.05   0.38
    32   1     0.01   0.00   0.01     0.00   0.00   0.00     0.01   0.00   0.01
    33   1     0.00  -0.00   0.00     0.00   0.00  -0.00     0.00  -0.00   0.00
    34   1    -0.00  -0.00  -0.00     0.00   0.00   0.00     0.00  -0.00   0.00
    35   1    -0.01   0.00  -0.01     0.01  -0.00   0.01     0.00  -0.00   0.00
    36   1    -0.35  -0.04   0.10     0.50   0.05  -0.14     0.10   0.01  -0.03
    37   1    -0.15  -0.03  -0.26     0.23   0.04   0.39     0.04   0.01   0.07

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  6 and mass  12.00000
 Atom     3 has atomic number  7 and mass  14.00307
 Atom     4 has atomic number 45 and mass 102.90480
 Atom     5 has atomic number  7 and mass  14.00307
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  6 and mass  12.00000
 Atom     8 has atomic number  7 and mass  14.00307
 Atom     9 has atomic number  7 and mass  14.00307
 Atom    10 has atomic number  7 and mass  14.00307
 Atom    11 has atomic number  6 and mass  12.00000
 Atom    12 has atomic number  1 and mass   1.00783
 Atom    13 has atomic number  1 and mass   1.00783
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  1 and mass   1.00783
 Atom    16 has atomic number  1 and mass   1.00783
 Atom    17 has atomic number  1 and mass   1.00783
 Atom    18 has atomic number  1 and mass   1.00783
 Atom    19 has atomic number  1 and mass   1.00783
 Atom    20 has atomic number  1 and mass   1.00783
 Atom    21 has atomic number  1 and mass   1.00783
 Atom    22 has atomic number  1 and mass   1.00783
 Atom    23 has atomic number  1 and mass   1.00783
 Atom    24 has atomic number  1 and mass   1.00783
 Atom    25 has atomic number  1 and mass   1.00783
 Atom    26 has atomic number  1 and mass   1.00783
 Atom    27 has atomic number  1 and mass   1.00783
 Atom    28 has atomic number  6 and mass  12.00000
 Atom    29 has atomic number  7 and mass  14.00307
 Atom    30 has atomic number  1 and mass   1.00783
 Atom    31 has atomic number  1 and mass   1.00783
 Atom    32 has atomic number  1 and mass   1.00783
 Atom    33 has atomic number  1 and mass   1.00783
 Atom    34 has atomic number  1 and mass   1.00783
 Atom    35 has atomic number  1 and mass   1.00783
 Atom    36 has atomic number  1 and mass   1.00783
 Atom    37 has atomic number  1 and mass   1.00783
 Molecular mass:   283.11104 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --  2573.971562610.576283843.64264
           X            1.00000  -0.00052  -0.00033
           Y            0.00052   1.00000   0.00001
           Z            0.00033  -0.00001   1.00000
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.03365     0.03318     0.02253
 Rotational constants (GHZ):           0.70115     0.69132     0.46954
 Zero-point vibrational energy     925981.6 (Joules/Mol)
                                  221.31492 (Kcal/Mol)
 Warning -- explicit consideration of  24 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:    121.13   126.52   146.45   207.96   208.88
          (Kelvin)            234.63   309.72   313.44   318.79   359.51
                              417.78   435.00   441.07   474.88   477.00
                              576.66   578.43   581.77   662.68   667.75
                              724.59   768.36   782.28   804.18   979.22
                              987.22  1028.71  1068.34  1072.44  1104.84
                             1246.32  1246.42  1248.31  1250.17  1255.52
                             1257.55  1412.45  1414.40  1415.03  1436.63
                             1439.93  1451.24  1508.14  1509.04  1511.21
                             1599.42  1609.80  1610.51  1684.28  1686.57
                             1711.83  1760.29  1764.39  1790.93  1859.32
                             1859.77  1866.53  1915.67  1918.93  1928.42
                             1938.76  1940.42  1943.00  2020.98  2022.02
                             2024.24  2076.37  2078.80  2079.57  2162.32
                             2163.14  2163.80  2164.18  2164.71  2164.86
                             2359.50  2383.33  2383.58  2386.33  2401.32
                             2404.73  4415.39  4418.08  4418.76  4423.78
                             4425.55  4426.12  4482.60  4483.66  4484.01
                             4497.00  4498.79  4499.32  4936.15  4937.75
                             4939.25  4939.49  4940.66  4942.16  5007.90
                             5008.24  5009.09  5009.79  5010.54  5010.71
 
 Zero-point correction=                           0.352688 (Hartree/Particle)
 Thermal correction to Energy=                    0.367694
 Thermal correction to Enthalpy=                  0.368638
 Thermal correction to Gibbs Free Energy=         0.312213
 Sum of electronic and zero-point Energies=           -681.282782
 Sum of electronic and thermal Energies=              -681.267775
 Sum of electronic and thermal Enthalpies=            -681.266831
 Sum of electronic and thermal Free Energies=         -681.323256
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                  230.732             60.537            118.757
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             42.820
 Rotational               0.889              2.981             31.624
 Vibrational            228.954             54.575             44.313
 Vibration     1          0.601              1.960              3.791
 Vibration     2          0.601              1.958              3.706
 Vibration     3          0.604              1.948              3.420
 Vibration     4          0.616              1.909              2.743
 Vibration     5          0.617              1.908              2.734
 Vibration     6          0.623              1.888              2.514
 Vibration     7          0.645              1.818              1.999
 Vibration     8          0.646              1.814              1.977
 Vibration     9          0.648              1.808              1.946
 Vibration    10          0.663              1.763              1.731
 Vibration    11          0.686              1.692              1.472
 Vibration    12          0.694              1.669              1.404
 Vibration    13          0.697              1.661              1.381
 Vibration    14          0.713              1.615              1.260
 Vibration    15          0.714              1.613              1.253
 Vibration    16          0.767              1.468              0.960
 Vibration    17          0.768              1.466              0.955
 Vibration    18          0.770              1.461              0.947
 Vibration    19          0.818              1.337              0.764
 Vibration    20          0.822              1.330              0.754
 Vibration    21          0.859              1.242              0.649
 Vibration    22          0.889              1.175              0.578
 Vibration    23          0.899              1.153              0.557
 Vibration    24          0.915              1.120              0.526
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.246609-143       -143.607991       -330.669620
 Total V=0       0.413979D+19         18.616978         42.867176
 Vib (Bot)       0.723990-158       -158.140268       -364.131423
 Vib (Bot)    1  0.244454D+01          0.388197          0.893857
 Vib (Bot)    2  0.233900D+01          0.369030          0.849723
 Vib (Bot)    3  0.201551D+01          0.304384          0.700871
 Vib (Bot)    4  0.140501D+01          0.147681          0.340047
 Vib (Bot)    5  0.139859D+01          0.145690          0.335465
 Vib (Bot)    6  0.123851D+01          0.092899          0.213909
 Vib (Bot)    7  0.920700D+00         -0.035882         -0.082621
 Vib (Bot)    8  0.908802D+00         -0.041531         -0.095628
 Vib (Bot)    9  0.892156D+00         -0.049559         -0.114114
 Vib (Bot)   10  0.781136D+00         -0.107274         -0.247006
 Vib (Bot)   11  0.658450D+00         -0.181477         -0.417866
 Vib (Bot)   12  0.628179D+00         -0.201916         -0.464930
 Vib (Bot)   13  0.618056D+00         -0.208972         -0.481176
 Vib (Bot)   14  0.566075D+00         -0.247126         -0.569028
 Vib (Bot)   15  0.563059D+00         -0.249446         -0.574371
 Vib (Bot)   16  0.444447D+00         -0.352180         -0.810925
 Vib (Bot)   17  0.442681D+00         -0.353909         -0.814906
 Vib (Bot)   18  0.439390D+00         -0.357150         -0.822369
 Vib (Bot)   19  0.369108D+00         -0.432847         -0.996667
 Vib (Bot)   20  0.365231D+00         -0.437432         -1.007225
 Vib (Bot)   21  0.325296D+00         -0.487721         -1.123019
 Vib (Bot)   22  0.298346D+00         -0.525279         -1.209500
 Vib (Bot)   23  0.290369D+00         -0.537050         -1.236604
 Vib (Bot)   24  0.278359D+00         -0.555395         -1.278844
 Vib (V=0)       0.121535D+05          4.084702          9.405373
 Vib (V=0)    1  0.299515D+01          0.476419          1.096994
 Vib (V=0)    2  0.289184D+01          0.461175          1.061894
 Vib (V=0)    3  0.257660D+01          0.411047          0.946471
 Vib (V=0)    4  0.199133D+01          0.299143          0.688803
 Vib (V=0)    5  0.198528D+01          0.297822          0.685760
 Vib (V=0)    6  0.183563D+01          0.263785          0.607387
 Vib (V=0)    7  0.154771D+01          0.189689          0.436774
 Vib (V=0)    8  0.153727D+01          0.186749          0.430005
 Vib (V=0)    9  0.152271D+01          0.182618          0.420494
 Vib (V=0)   10  0.142746D+01          0.154562          0.355893
 Vib (V=0)   11  0.132677D+01          0.122797          0.282751
 Vib (V=0)   12  0.130288D+01          0.114903          0.264574
 Vib (V=0)   13  0.129498D+01          0.112263          0.258495
 Vib (V=0)   14  0.125528D+01          0.098739          0.227355
 Vib (V=0)   15  0.125302D+01          0.097957          0.225555
 Vib (V=0)   16  0.116898D+01          0.067807          0.156131
 Vib (V=0)   17  0.116781D+01          0.067371          0.155128
 Vib (V=0)   18  0.116563D+01          0.066561          0.153262
 Vib (V=0)   19  0.112148D+01          0.049792          0.114651
 Vib (V=0)   20  0.111919D+01          0.048903          0.112603
 Vib (V=0)   21  0.109650D+01          0.040010          0.092127
 Vib (V=0)   22  0.108225D+01          0.034326          0.079039
 Vib (V=0)   23  0.107820D+01          0.032699          0.075292
 Vib (V=0)   24  0.107226D+01          0.030301          0.069770
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.187236D+09          8.272389         19.047880
 Rotational      0.181923D+07          6.259887         14.413923
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6          -0.000006088    0.000012393   -0.000029127
      2        6          -0.000010412    0.000020222   -0.000034694
      3        7           0.000015876    0.000014806   -0.000008825
      4       45          -0.000147600    0.000110840    0.000102558
      5        7           0.000059605   -0.000019709   -0.000018586
      6        6           0.000014122   -0.000007460    0.000008579
      7        6           0.000002758    0.000001907   -0.000008789
      8        7           0.000029479   -0.000028418   -0.000008724
      9        7          -0.000000888   -0.000028104   -0.000013477
     10        7           0.000010204   -0.000014395    0.000052549
     11        6          -0.000007777   -0.000026181   -0.000004356
     12        1           0.000001921    0.000000267   -0.000006840
     13        1           0.000000492   -0.000007520    0.000003449
     14        1          -0.000002219    0.000001846   -0.000003140
     15        1          -0.000004731    0.000006858    0.000010442
     16        1           0.000002366   -0.000000071    0.000004905
     17        1          -0.000008382    0.000001925    0.000022934
     18        1          -0.000001403   -0.000000853    0.000006386
     19        1          -0.000012893    0.000022904    0.000006771
     20        1           0.000034521    0.000012632    0.000013881
     21        1           0.000013770   -0.000002426    0.000003623
     22        1           0.000008119    0.000021941   -0.000013458
     23        1          -0.000012768   -0.000006964   -0.000017925
     24        1           0.000008942   -0.000011910   -0.000009158
     25        1          -0.000000027   -0.000006176   -0.000006194
     26        1           0.000070267   -0.000031160    0.000022512
     27        1           0.000016582    0.000000349    0.000004700
     28        6           0.000000779   -0.000008409   -0.000004398
     29        7          -0.000017702    0.000033792   -0.000003405
     30        1          -0.000007599   -0.000007372   -0.000002012
     31        1          -0.000018064   -0.000004230   -0.000029566
     32        1          -0.000016680   -0.000003441   -0.000034098
     33        1          -0.000002897   -0.000000294   -0.000001814
     34        1           0.000001088   -0.000001170    0.000000741
     35        1          -0.000004516   -0.000015381    0.000006992
     36        1          -0.000001203   -0.000031990   -0.000012591
     37        1          -0.000007043    0.000000951    0.000000152
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000147600 RMS     0.000026321
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.157335D+03 -0.354420D-02 -0.259076D-01
      2  -0.354420D-02  0.156142D+03 -0.674529D-03
      3  -0.259076D-01 -0.674529D-03  0.126187D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1  -0.307068D+01  0.122557D+00  0.210596D+01
      2   0.718464D-01  0.181442D+01 -0.394987D-01
      3   0.270821D+01 -0.102079D+00 -0.284749D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.667495D+01 -0.103257D+03 -0.231711D+00
      2   0.681121D+01  0.109894D+03  0.212668D+00
      3  -0.136254D+00 -0.663702D+01  0.190430D-01
      4  -0.100433D+03  0.685889D+01 -0.520817D+01
      5  -0.201957D+00  0.139852D+01 -0.239880D+00
      6  -0.102715D+02  0.181801D+00 -0.100262D+02
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=   111 ND12= 1 LenFil=    3999:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.888347D+01  0.104538D+01  0.438423D+01 -0.884547D+00 -0.295936D+01
      2   0.104538D+01 -0.263258D+01  0.945579D-01 -0.295936D+01  0.702687D+00
      3   0.438423D+01  0.945579D-01  0.577987D+00 -0.648214D+00  0.230731D+01
                 6             7             8             9            10 
      1  -0.648214D+00  0.317129D+01 -0.370550D+00  0.689624D+00 -0.104848D+01
      2   0.230731D+01 -0.370550D+00  0.160519D+01  0.127922D+01  0.111143D+01
      3   0.104187D+01  0.689624D+00  0.127922D+01 -0.526016D+00 -0.265325D+01
                11            12            13            14            15 
      1   0.111143D+01 -0.265325D+01  0.255447D+01  0.591839D+01 -0.106102D+01
      2   0.445208D+01 -0.260774D+00  0.591839D+01  0.304234D+01 -0.379239D+01
      3  -0.260774D+00  0.930320D+00 -0.106102D+01 -0.379239D+01 -0.237409D+00
                16            17            18            19            20 
      1  -0.171912D+01 -0.394662D+00  0.126514D+01 -0.278030D+01 -0.416453D+01
      2  -0.394662D+00 -0.284902D+01 -0.223271D+00 -0.416453D+01 -0.658637D+01
      3   0.126514D+01 -0.223271D+00  0.607340D+00  0.346071D+01  0.261656D+01
                21            22            23            24            25 
      1   0.346071D+01 -0.195975D+01 -0.439296D+01  0.138689D+01  0.196454D+01
      2   0.261656D+01 -0.439296D+01 -0.272912D+01  0.278444D+01  0.131074D+01
      3  -0.139492D+01  0.138689D+01  0.278444D+01 -0.159787D+01 -0.117612D+01
                26            27            28            29            30 
      1   0.131074D+01 -0.117612D+01  0.116202D+00  0.205626D+01  0.183799D-02
      2   0.305679D+01 -0.185894D+01  0.205626D+01 -0.160266D+00 -0.168694D+01
      3  -0.185894D+01 -0.189127D+01  0.183799D-02 -0.168694D+01  0.308020D-02
                31            32            33            34            35 
      1   0.192979D+01 -0.143402D+00  0.197756D+01 -0.550450D-02 -0.651887D-01
      2  -0.143402D+00 -0.241352D+01 -0.207093D-02 -0.651887D-01  0.237591D-02
      3   0.197756D+01 -0.207093D-02  0.270907D+00  0.323649D-02  0.132091D+00
                36            37            38            39            40 
      1   0.323649D-02  0.235242D+01 -0.378348D+01 -0.327844D+01 -0.167541D+01
      2   0.132091D+00 -0.378348D+01  0.680207D+01  0.263349D+01  0.450955D+01
      3  -0.287421D-02 -0.327844D+01  0.263349D+01  0.132526D+01  0.140141D+01
                41            42            43            44            45 
      1   0.450955D+01  0.140141D+01 -0.185841D+01  0.125333D+01  0.109133D+01
      2  -0.341592D+01 -0.296407D+01  0.125333D+01 -0.317584D+01 -0.189691D+01
      3  -0.296407D+01 -0.164743D+01  0.109133D+01 -0.189691D+01  0.189449D+01
                46            47            48            49            50 
      1   0.123713D+01  0.614379D+00  0.259529D+01  0.199057D+01 -0.590295D+01
      2   0.614379D+00 -0.437565D+01 -0.205832D+00 -0.590295D+01  0.375499D+01
      3   0.259529D+01 -0.205832D+00 -0.943341D+00 -0.100370D+01  0.384504D+01
                51            52            53            54            55 
      1  -0.100370D+01  0.168435D+01 -0.337903D+00 -0.127304D+01 -0.879366D+01
      2   0.384504D+01 -0.337903D+00  0.287896D+01 -0.178532D+00  0.165986D+01
      3  -0.204955D+00 -0.127304D+01 -0.178532D+00 -0.604889D+00 -0.439803D+01
                56            57            58            59            60 
      1   0.165986D+01 -0.439803D+01 -0.259974D+00  0.294805D+01 -0.561796D+00
      2   0.253360D+01  0.182783D+00  0.294805D+01  0.330985D+00 -0.228572D+01
      3   0.182783D+00 -0.525570D+00 -0.561796D+00 -0.228572D+01  0.106683D+01
                61            62            63            64            65 
      1  -0.318950D+01 -0.303586D+00 -0.626738D+00  0.100096D+02 -0.164076D+01
      2  -0.303586D+00 -0.157652D+01  0.131048D+01 -0.164076D+01 -0.143256D+01
      3  -0.626738D+00  0.131048D+01  0.522890D+00  0.501589D+01 -0.612592D+00
                66            67            68            69            70 
      1   0.501589D+01 -0.470609D+01 -0.558585D+00 -0.193528D+01  0.404066D+01
      2  -0.612592D+00 -0.558585D+00 -0.687051D+00  0.166251D+01  0.145261D-01
      3   0.232812D+01 -0.193528D+01  0.166251D+01 -0.701939D+00  0.229715D+01
                71            72            73            74            75 
      1   0.145261D-01  0.229715D+01 -0.103067D+02 -0.111611D+01 -0.511510D+01
      2   0.112934D+01 -0.281797D+00 -0.111611D+01  0.152246D+01 -0.465177D+00
      3  -0.281797D+00 -0.186271D+01 -0.511510D+01 -0.465177D+00 -0.235260D+01
                76            77            78            79            80 
      1  -0.421542D+01  0.778793D+00 -0.179139D+01 -0.403028D+01  0.138436D+00
      2   0.778793D+00 -0.798579D+00 -0.156069D+01  0.138436D+00 -0.113513D+01
      3  -0.179139D+01 -0.156069D+01 -0.600618D+00 -0.230603D+01 -0.183488D+00
                81            82            83            84            85 
      1  -0.230603D+01 -0.612704D+00  0.174638D+01  0.974525D+00  0.263158D+01
      2  -0.183488D+00  0.174638D+01  0.183919D+01 -0.125917D+01  0.451523D+01
      3   0.186569D+01  0.974525D+00 -0.125917D+01  0.135998D+01 -0.199610D+01
                86            87            88            89            90 
      1   0.451523D+01 -0.199610D+01  0.302809D+00 -0.116293D+01  0.219376D+01
      2   0.891407D+01 -0.525611D+01 -0.116293D+01 -0.313371D+01  0.102139D+01
      3  -0.525611D+01  0.124702D+01  0.219376D+01  0.102139D+01  0.844301D+00
                91            92            93            94            95 
      1  -0.130087D+01 -0.495922D+00 -0.245798D+01 -0.775243D+00 -0.230730D+01
      2  -0.495922D+00 -0.338630D+00  0.578109D+00 -0.230730D+01 -0.484473D+01
      3  -0.245798D+01  0.578109D+00 -0.160962D+01  0.627388D+00  0.488983D+01
                96            97            98            99           100 
      1   0.627388D+00 -0.300794D+01  0.125852D+01 -0.218193D+01  0.115123D+02
      2   0.488983D+01  0.125852D+01  0.650712D+01 -0.200965D+01 -0.232407D+01
      3  -0.959504D+00 -0.218193D+01 -0.200965D+01  0.213487D+00  0.343687D+01
               101           102           103           104           105 
      1  -0.232407D+01  0.343687D+01  0.212029D+00  0.101953D+01  0.329793D+00
      2   0.141679D+01 -0.596729D+00  0.101953D+01 -0.854837D+00  0.691250D+00
      3  -0.596729D+00  0.220283D+01  0.329793D+00  0.691250D+00 -0.212991D+00
               106           107           108           109           110 
      1   0.324992D+01 -0.643971D+00  0.257731D+01 -0.380726D+00 -0.835237D+00
      2  -0.643971D+00  0.635157D+00 -0.797532D+00 -0.835237D+00 -0.145870D+01
      3   0.257731D+01 -0.797532D+00  0.166795D+01  0.102484D+01  0.552926D+00
               111           112           113           114           115 
      1   0.102484D+01 -0.102889D+01 -0.182791D+00  0.103606D+00  0.123398D+01
      2   0.552926D+00 -0.182791D+00 -0.450910D+01  0.218255D+01 -0.230519D+00
      3  -0.862233D+00  0.103606D+00  0.218255D+01 -0.220983D+01  0.548114D-01
               116           117           118           119           120 
      1  -0.230519D+00  0.548114D-01  0.375246D+01 -0.262745D+01 -0.125623D+01
      2   0.197127D+01 -0.179634D+01 -0.262745D+01  0.274770D+01  0.649113D+00
      3  -0.179634D+01  0.227585D+01 -0.125623D+01  0.649113D+00  0.110596D+01
               121           122           123           124           125 
      1  -0.421823D+01  0.488878D+01  0.153256D+01 -0.156345D+01  0.130803D+01
      2   0.488878D+01 -0.728752D+01 -0.257877D+01  0.130803D+01 -0.202733D+01
      3   0.153256D+01 -0.257877D+01 -0.172947D+01  0.174818D+01 -0.180491D+01
               126           127           128           129           130 
      1   0.174818D+01  0.322586D+01  0.949653D+00 -0.169983D+01  0.216634D+01
      2  -0.180491D+01  0.949653D+00  0.115410D+01 -0.445286D+00  0.150378D+01
      3  -0.143646D+01 -0.169983D+01 -0.445286D+00  0.157698D+01 -0.848394D+00
               131           132           133           134           135 
      1   0.150378D+01 -0.848394D+00 -0.204467D+01 -0.160952D+00  0.159255D+01
      2   0.194888D+01 -0.144964D+01 -0.160952D+00 -0.118562D+01  0.749135D+00
      3  -0.144964D+01  0.169588D+01  0.159255D+01  0.749135D+00 -0.217219D+01
               136           137           138           139           140 
      1  -0.417907D+01 -0.278837D+01  0.135488D+01 -0.447259D+01 -0.488643D+01
      2  -0.278837D+01 -0.281569D+01  0.703500D+00 -0.488643D+01 -0.673626D+01
      3   0.135488D+01  0.703500D+00 -0.118060D+01  0.158793D+01  0.248292D+01
               141           142           143           144           145 
      1   0.158793D+01  0.168255D+01  0.132660D+01 -0.182767D+01 -0.305812D+01
      2   0.248292D+01  0.132660D+01  0.191573D+01 -0.173002D+01  0.970618D+00
      3  -0.168191D+01 -0.182767D+01 -0.173002D+01  0.143953D+01  0.164283D+01
               146           147           148           149           150 
      1   0.970618D+00  0.164283D+01  0.217531D+01 -0.155461D+01 -0.856810D+00
      2  -0.115381D+01 -0.453269D+00 -0.155461D+01  0.213508D+01  0.150636D+01
      3  -0.453269D+00 -0.150133D+01 -0.856810D+00  0.150636D+01  0.176052D+01
               151           152           153           154           155 
      1   0.202991D+01 -0.196208D+00 -0.155664D+01 -0.116745D+02 -0.192921D+01
      2  -0.196208D+00  0.120066D+01  0.815544D+00 -0.192921D+01 -0.126774D+01
      3  -0.155664D+01  0.815544D+00  0.216485D+01 -0.344599D+01 -0.479864D+00
               156           157           158           159           160 
      1  -0.344599D+01  0.621692D+00 -0.980610D+00  0.447114D+00 -0.330905D+01
      2  -0.479864D+00 -0.980610D+00 -0.713739D+00 -0.685861D+00 -0.531918D+00
      3  -0.221234D+01  0.447114D+00 -0.685861D+00 -0.118641D+00 -0.261383D+01
               161           162           163           164           165 
      1  -0.531918D+00 -0.261383D+01  0.270885D+00 -0.785730D+00 -0.999031D+00
      2  -0.586188D+00 -0.687383D+00 -0.785730D+00  0.133544D+01  0.501947D+00
      3  -0.687383D+00 -0.167130D+01 -0.999031D+00  0.501947D+00  0.765204D+00
               166           167           168           169           170 
      1  -0.104243D+01  0.664503D-01  0.524136D-01 -0.125863D+01 -0.261362D+00
      2   0.664503D-01 -0.458795D+01 -0.220818D+01 -0.261362D+00 -0.194906D+01
      3   0.524136D-01 -0.220818D+01 -0.224380D+01 -0.132811D+00 -0.179088D+01
               171           172           173           174           175 
      1  -0.132811D+00 -0.250612D+01  0.176579D+01  0.608363D-01  0.380911D+01
      2  -0.179088D+01  0.176579D+01 -0.238919D+01  0.401923D+00 -0.142029D+01
      3  -0.227143D+01  0.608363D-01  0.401923D+00 -0.459229D+00  0.149564D+01
               176           177           178           179           180 
      1  -0.142029D+01  0.149564D+01  0.179803D+01  0.477670D+00  0.286409D+00
      2   0.353779D+01 -0.197613D+00  0.477670D+00  0.149714D+00  0.701552D+00
      3  -0.197613D+00  0.125773D+01  0.286409D+00  0.701552D+00 -0.214747D+00
               181           182           183           184           185 
      1   0.147829D+01  0.379824D+00  0.238795D+00 -0.100450D+00 -0.686709D+00
      2   0.379824D+00 -0.602863D+00  0.396960D-01 -0.686709D+00  0.112113D+00
      3   0.238795D+00  0.396960D-01  0.812403D+00  0.305405D-01 -0.806216D+00
               186           187           188           189           190 
      1   0.305405D-01 -0.203592D+01 -0.245423D+00 -0.146595D+01  0.156257D+01
      2  -0.806216D+00 -0.245423D+00 -0.110662D+01  0.701275D+00  0.155249D-01
      3   0.132626D+00 -0.146595D+01  0.701275D+00 -0.750002D+01 -0.672398D+00
               191           192           193           194           195 
      1   0.155249D-01 -0.672398D+00 -0.191303D+01  0.827778D+00 -0.307877D-01
      2   0.227708D+01 -0.110020D+01  0.827778D+00 -0.626791D+01  0.100323D+01
      3  -0.110020D+01  0.760370D+00 -0.307877D-01  0.100323D+01 -0.112713D+01
               196           197           198           199           200 
      1  -0.986577D+00 -0.963514D+00  0.687145D+00 -0.390031D+00  0.242475D+00
      2  -0.963514D+00 -0.827098D+00 -0.200490D+00  0.242475D+00  0.731343D+00
      3   0.687145D+00 -0.200490D+00  0.308128D+00  0.469749D+00 -0.391034D+00
               201           202           203           204           205 
      1   0.469749D+00  0.617971D+00  0.116004D+01 -0.488010D+00  0.153676D+01
      2  -0.391034D+00  0.116004D+01  0.193627D+00  0.109442D+00  0.546039D+00
      3   0.317253D+00 -0.488010D+00  0.109442D+00  0.674452D+00 -0.344555D+00
               206           207           208           209           210 
      1   0.546039D+00 -0.344555D+00 -0.165953D+01 -0.634624D-01  0.619112D+00
      2   0.150010D+01 -0.149347D+01 -0.634624D-01 -0.254684D+01 -0.116738D+01
      3  -0.149347D+01  0.735553D+01  0.619112D+00 -0.116738D+01 -0.807366D+00
               211           212           213           214           215 
      1  -0.192519D+01 -0.101705D+01 -0.101744D+00  0.905652D+00 -0.964134D+00
      2  -0.101705D+01 -0.607870D+01 -0.940189D+00 -0.964134D+00  0.922497D+00
      3  -0.101744D+00 -0.940189D+00 -0.108937D+01 -0.695006D+00 -0.168857D+00
               216           217           218           219           220 
      1  -0.695006D+00  0.430146D+00  0.140052D+00 -0.507547D+00  0.493557D+00
      2  -0.168857D+00  0.140052D+00 -0.737136D+00 -0.373743D+00 -0.117980D+01
      3  -0.302816D+00 -0.507547D+00 -0.373743D+00 -0.290530D+00 -0.468292D+00
               221           222           223           224           225 
      1  -0.117980D+01 -0.468292D+00 -0.148893D+01  0.547256D+00  0.275402D+00
      2   0.322667D+00 -0.738110D-01  0.547256D+00 -0.155124D+01 -0.151708D+01
      3  -0.738110D-01  0.676727D+00  0.275402D+00 -0.151708D+01 -0.735324D+01
               226           227           228           229           230 
      1   0.281460D+01  0.181230D+01  0.174354D-01  0.380533D+01  0.132510D+01
      2   0.181230D+01  0.238443D+01  0.409016D+00  0.132510D+01  0.331759D+01
      3   0.174354D-01  0.409016D+00  0.509971D+00  0.150007D+01  0.115445D+00
               231           232           233           234           235 
      1   0.150007D+01 -0.175284D+01  0.547145D+00 -0.256501D+00 -0.143998D+01
      2   0.115445D+00  0.547145D+00 -0.192846D+00  0.712923D+00  0.496939D+00
      3   0.123595D+01 -0.256501D+00  0.712923D+00  0.214811D+00 -0.233387D+00
               236           237           238           239           240 
      1   0.496939D+00 -0.233387D+00  0.199782D-01  0.672160D+00  0.743340D-01
      2   0.569472D+00  0.837922D-01  0.672160D+00  0.278476D-01  0.800499D+00
      3   0.837922D-01 -0.806539D+00  0.743340D-01  0.800499D+00  0.167299D+00
               241           242           243           244           245 
      1   0.201161D+01 -0.284943D+00  0.149434D+01  0.123125D+01 -0.443818D+00
      2  -0.284943D+00  0.112903D+01  0.636937D+00 -0.443818D+00  0.161757D+00
      3   0.149434D+01  0.636937D+00  0.749611D+01  0.249832D+01  0.249935D+00
               246           247           248           249           250 
      1   0.249832D+01 -0.634341D+00  0.214002D+01  0.301051D+00  0.310061D+01
      2   0.249935D+00  0.214002D+01 -0.506140D+01 -0.492961D+01  0.832753D+00
      3   0.156470D+01  0.301051D+00 -0.492961D+01 -0.102872D+01  0.208923D+01
               251           252           253           254           255 
      1   0.832753D+00  0.208923D+01  0.863730D+00  0.143281D+01 -0.111322D+01
      2  -0.660312D+01 -0.210210D+01  0.143281D+01 -0.156467D+01 -0.969850D+00
      3  -0.210210D+01 -0.213449D+00 -0.111322D+01 -0.969850D+00 -0.129981D+01
               256           257           258           259           260 
      1   0.220423D+01 -0.428109D+01 -0.171066D+01 -0.399147D+00 -0.100318D+01
      2  -0.428109D+01  0.937210D+01  0.538187D+01 -0.100318D+01  0.323444D+01
      3  -0.171066D+01  0.538187D+01  0.130117D+01 -0.214488D+01  0.111472D+01
               261           262           263           264           265 
      1  -0.214488D+01  0.560105D+01  0.729860D+00 -0.267342D+01 -0.510622D-01
      2   0.111472D+01  0.729860D+00  0.258378D+01 -0.621572D+00  0.163374D+00
      3  -0.842890D+00 -0.267342D+01 -0.621572D+00  0.209272D+01  0.457533D+00
               266           267           268           269           270 
      1   0.163374D+00  0.457533D+00 -0.170255D+01  0.208241D+00  0.120100D+01
      2  -0.109603D+01  0.669443D+00  0.208241D+00  0.432231D+00  0.775469D-02
      3   0.669443D+00 -0.419111D+00  0.120100D+01  0.775469D-02 -0.185361D+01
               271           272           273           274           275 
      1  -0.486647D+00 -0.592529D+00 -0.740712D+00  0.125058D+00 -0.923621D+00
      2  -0.592529D+00 -0.248664D+01  0.115705D+01 -0.923621D+00 -0.217714D+00
      3  -0.740712D+00  0.115705D+01 -0.214525D+01  0.438385D+00 -0.183515D+00
               276           277           278           279           280 
      1   0.438385D+00 -0.109126D+01 -0.998162D-01 -0.514045D+00  0.426318D+01
      2  -0.183515D+00 -0.998162D-01 -0.167407D+01  0.135348D+01  0.124945D+01
      3   0.488108D+00 -0.514045D+00  0.135348D+01 -0.588763D+01  0.166246D+01
               281           282           283           284           285 
      1   0.124945D+01  0.166246D+01  0.531872D+00  0.126805D+01  0.985529D-01
      2   0.213908D+01  0.427539D+00  0.126805D+01  0.981136D+00  0.298595D+00
      3   0.427539D+00  0.150784D+01  0.985529D-01  0.298595D+00  0.273086D+00
               286           287           288           289           290 
      1   0.270535D+01  0.503283D+00  0.182354D+01  0.103086D+01  0.179092D+01
      2   0.503283D+00  0.872743D+00  0.989933D+00  0.179092D+01  0.130954D+01
      3   0.182354D+01  0.989933D+00  0.220087D+01 -0.417457D+00 -0.582075D+00
               291           292           293           294           295 
      1  -0.417457D+00  0.155833D+01  0.189171D+01 -0.671515D+00 -0.445825D+00
      2  -0.582075D+00  0.189171D+01  0.978715D+01 -0.318131D+01 -0.145389D+01
      3   0.497534D+00 -0.671515D+00 -0.318131D+01  0.204639D+01  0.105180D+01
               296           297           298           299           300 
      1  -0.145389D+01  0.105180D+01 -0.809482D+00  0.170295D+01  0.366958D+00
      2  -0.561061D+01  0.334650D+01  0.170295D+01 -0.102575D+01 -0.456789D+00
      3   0.334650D+01 -0.261814D+01  0.366958D+00 -0.456789D+00 -0.405772D+00
               301           302           303           304           305 
      1   0.144432D+01 -0.159715D+01 -0.546558D+00  0.326990D+00 -0.121950D+01
      2  -0.159715D+01  0.999622D+01  0.323002D+01 -0.121950D+01  0.572817D+01
      3  -0.546558D+00  0.323002D+01  0.206548D+01 -0.902089D+00  0.338866D+01
               306           307           308           309           310 
      1  -0.902089D+00 -0.412791D+01  0.128359D+01 -0.163713D+01  0.605170D+00
      2   0.338866D+01  0.128359D+01 -0.220308D+01  0.488442D+00 -0.130214D+01
      3   0.261607D+01 -0.163713D+01  0.488442D+00 -0.149413D+01  0.157652D+00
               311           312           313           314           315 
      1  -0.130214D+01  0.157652D+00 -0.265741D+01  0.582865D+00 -0.177787D+01
      2   0.119361D+01 -0.324012D+00  0.582865D+00 -0.919552D+00  0.106896D+01
      3  -0.324012D+00  0.339420D+00 -0.177787D+01  0.106896D+01 -0.220086D+01
               316           317           318           319           320 
      1  -0.552779D+01  0.854803D+00  0.266282D+01  0.178627D+00 -0.246891D+00
      2   0.854803D+00 -0.270143D+01 -0.770908D+00 -0.246891D+00 -0.959436D+00
      3   0.266282D+01 -0.770908D+00 -0.211151D+01  0.309334D+00 -0.654940D+00
               321           322           323           324           325 
      1   0.309334D+00  0.172036D+01  0.111492D+00 -0.120164D+01  0.446758D+00
      2  -0.654940D+00  0.111492D+00 -0.444355D+00  0.630194D-01 -0.460581D+00
      3  -0.324695D+00 -0.120164D+01  0.630194D-01  0.185674D+01  0.810759D+00
               326           327           328           329           330 
      1  -0.460581D+00  0.810759D+00  0.187316D+00  0.926966D+00  0.410518D+00
      2   0.251971D+01  0.112879D+01  0.926966D+00 -0.411348D+00  0.113960D+00
      3   0.112879D+01  0.216420D+01  0.410518D+00  0.113960D+00  0.393943D+00
               331           332           333 
      1   0.108169D+01 -0.727554D-01  0.575379D+00
      2  -0.727554D-01  0.167643D+01  0.132807D+01
      3   0.575379D+00  0.132807D+01  0.588193D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.326266D-01  0.216687D+01 -0.298267D+01  0.323998D+01  0.587016D+01
      2   0.226891D+01 -0.116421D+00  0.988102D+01 -0.640883D+00 -0.124726D+02
      3  -0.324675D+01 -0.104507D+02 -0.185909D+01 -0.631506D+01  0.519168D+01
                 6             7             8             9            10 
      1  -0.255734D+01 -0.261620D+00 -0.732478D+00 -0.785746D+00 -0.416581D+01
      2  -0.355031D+01  0.251980D+01  0.735593D+00  0.337309D+00  0.102986D+02
      3   0.946811D+01 -0.141978D+01  0.103074D+02  0.349060D+01  0.436035D+01
                11            12            13            14            15 
      1   0.476827D+01  0.518888D-01  0.463242D+01 -0.115156D+01 -0.780501D+01
      2  -0.377624D+01  0.429695D+01 -0.521012D+01  0.176204D+00  0.621811D+01
      3   0.651203D+01  0.751581D+01  0.999827D+01 -0.594850D+01 -0.643500D+01
                16            17            18            19            20 
      1  -0.128923D+01 -0.146575D+01 -0.326808D+00  0.128064D+00 -0.133459D+01
      2   0.160452D+01  0.786595D+00 -0.344689D+00 -0.135404D+02 -0.657483D+01
      3   0.816857D+01 -0.676362D+01 -0.333873D+01 -0.154870D+02 -0.126792D+02
                21            22            23            24            25 
      1   0.633159D+01  0.712492D+01  0.211452D+02 -0.520390D+01  0.125061D+02
      2   0.102129D+00 -0.331661D+01  0.463976D+01 -0.564610D+01 -0.117516D+02
      3   0.411624D+01  0.619140D+01  0.224580D+02 -0.749578D+01  0.304324D+01
                26            27            28            29            30 
      1   0.167767D+02 -0.209208D+02 -0.185185D+00 -0.365405D+01  0.316515D-01
      2  -0.107930D+02  0.120877D+02 -0.344876D+01  0.263510D+00  0.183136D+00
      3  -0.164388D+01  0.571545D+00 -0.932169D-03 -0.141011D+01 -0.389579D-01
                31            32            33            34            35 
      1  -0.173302D+01  0.195079D+00  0.323893D+00 -0.889742D-01 -0.305617D+00
      2   0.658731D-01  0.124639D+01 -0.296703D-03  0.767601D+00  0.129284D+00
      3  -0.354211D+00 -0.115509D-01  0.142427D+01  0.518859D-01  0.746821D+00
                36            37            38            39            40 
      1   0.857185D-01 -0.485564D+00 -0.197916D+01 -0.648667D+01  0.638241D+01
      2  -0.431495D+00 -0.130363D+02  0.739400D+01  0.624551D+00  0.384606D+01
      3  -0.243047D-01  0.150555D+02 -0.143331D+02 -0.440012D+01  0.452373D+01
                41            42            43            44            45 
      1  -0.211651D+02 -0.465820D+01 -0.121832D+02  0.178273D+02  0.213795D+02
      2   0.507791D+01  0.584704D+01 -0.106933D+02  0.104862D+02  0.111099D+02
      3  -0.220884D+02 -0.729474D+01 -0.310047D+01 -0.142048D+01 -0.576549D+00
                46            47            48            49            50 
      1   0.503101D+01  0.475582D+01 -0.232207D+00  0.467936D+01  0.745234D+00
      2   0.104706D+02  0.312379D+01  0.404215D+01  0.454432D+01 -0.217317D+00
      3  -0.365191D+01  0.688304D+01 -0.779921D+01  0.103891D+02  0.519880D+01
                51            52            53            54            55 
      1  -0.806869D+01  0.128099D+01 -0.156455D+01  0.328222D+00  0.333022D+00
      2  -0.606555D+01  0.149670D+01 -0.794459D+00 -0.343767D+00  0.228485D+01
      3  -0.610257D+01 -0.844883D+01 -0.642479D+01  0.336105D+01  0.257245D+01
                56            57            58            59            60 
      1   0.187003D+01  0.328035D+01  0.298194D+01 -0.664242D+01 -0.254557D+01
      2  -0.601100D+00  0.988331D+01 -0.107799D+00 -0.122060D+02  0.324448D+01
      3  -0.107552D+02  0.227447D+01 -0.661994D+01 -0.442900D+01  0.937438D+01
                61            62            63            64            65 
      1   0.328161D+00 -0.779288D+00  0.783074D+00 -0.667420D+01 -0.100090D+02
      2   0.247059D+01 -0.798906D+00  0.286440D+00  0.183700D+02 -0.203930D+01
      3   0.187485D+01  0.102430D+02 -0.350015D+01  0.104215D+02  0.889848D+01
                66            67            68            69            70 
      1  -0.516267D+01 -0.166391D+02  0.272703D+01 -0.683754D+01 -0.269972D+01
      2   0.268322D+00  0.516192D+01  0.550312D+01  0.501710D+01 -0.254721D+02
      3   0.428055D+01  0.265913D+02 -0.288698D+01  0.725667D+01 -0.319146D+00
                71            72            73            74            75 
      1   0.230735D+01 -0.217596D+00  0.633984D+01 -0.103080D+02  0.491095D+01
      2   0.278125D+01 -0.248481D+02  0.180477D+02  0.197108D+01 -0.162185D+00
      3   0.389412D+01  0.774144D+00 -0.894387D+01  0.944743D+01 -0.400506D+01
                76            77            78            79            80 
      1  -0.172902D+02 -0.136737D+01 -0.727932D+01  0.174947D+01  0.210220D+01
      2  -0.490245D+01  0.575988D+01 -0.472071D+01 -0.256509D+02 -0.182514D+01
      3   0.271680D+02  0.138965D+01  0.745418D+01  0.384427D+00  0.389019D+01
                81            82            83            84            85 
      1  -0.844493D+00 -0.493938D+01  0.318729D+01  0.179198D+01  0.146247D+01
      2  -0.248534D+02 -0.140950D+02 -0.133621D+02  0.133458D+02 -0.467630D+01
      3  -0.789030D+00 -0.193849D+02 -0.216567D+02  0.141947D+02 -0.294351D+01
                86            87            88            89            90 
      1   0.142059D+02  0.379085D+01  0.790165D+01  0.224620D+02 -0.141075D+02
      2  -0.837468D-01 -0.398983D+01 -0.250192D+01 -0.132143D+02  0.113156D+02
      3   0.108730D+02  0.260353D+00  0.749216D+01 -0.151346D+01  0.281349D+01
                91            92            93            94            95 
      1   0.826738D+01  0.326953D+01  0.727143D+01  0.456570D+01 -0.955378D+01
      2  -0.206202D+01  0.101307D+01 -0.302946D+00 -0.949008D-02  0.265913D+01
      3  -0.727209D+01 -0.134502D+01 -0.636905D+01  0.488507D+01  0.870054D+00
                96            97            98            99           100 
      1  -0.528318D+01  0.559583D+01 -0.298856D+01  0.165076D+01  0.897948D+00
      2  -0.484238D+00 -0.363298D+01  0.393368D+00 -0.444995D+00 -0.365796D+01
      3  -0.723196D+01 -0.113276D+02 -0.765429D+01 -0.618624D+01 -0.824289D+01
               101           102           103           104           105 
      1   0.204413D+01  0.292369D+01 -0.351396D+00  0.114179D+01 -0.111450D+01
      2   0.176229D+01  0.472251D+01 -0.219761D+01  0.196241D+01 -0.167125D+01
      3  -0.402307D+01 -0.349497D+01 -0.623282D+00 -0.396650D+00 -0.178253D+01
               106           107           108           109           110 
      1   0.211020D+01  0.104751D+01  0.142393D+01  0.142884D+01 -0.145324D+01
      2   0.208757D+01 -0.489949D+00  0.249691D+01  0.502325D+01  0.241752D+01
      3  -0.141877D+01 -0.282698D+01 -0.101231D+01  0.542578D+01  0.572279D+01
               111           112           113           114           115 
      1  -0.191652D+01 -0.340840D+00 -0.145273D+01 -0.309083D+01 -0.303926D+00
      2  -0.368480D+01  0.152666D+01  0.679228D+01 -0.649653D+01 -0.327575D+01
      3  -0.367115D+01  0.500257D+01  0.131407D+02 -0.668587D+01 -0.182751D+01
               116           117           118           119           120 
      1   0.178073D+00  0.223539D+01 -0.772641D+00 -0.264800D+00  0.217323D+01
      2  -0.499740D+01  0.615870D+01 -0.101681D+01  0.660491D+00  0.371619D+01
      3  -0.555300D+01  0.585095D+01  0.257092D+00 -0.377919D+01  0.394264D-01
               121           122           123           124           125 
      1  -0.288541D+01  0.298331D+01 -0.236963D+01  0.125944D+01 -0.464396D+00
      2  -0.329698D+01 -0.322761D+00 -0.354521D+01  0.868496D+00 -0.287521D+01
      3  -0.375684D+00  0.908888D+01  0.390893D+01  0.177062D+01  0.251155D+01
               126           127           128           129           130 
      1  -0.145487D+01 -0.441461D+01 -0.180161D+01  0.281058D+01 -0.290741D+01
      2  -0.220854D+01 -0.229776D+01  0.261954D+00  0.381480D+01  0.872428D+00
      3   0.101553D+01 -0.767518D+01 -0.627999D+01  0.445055D+01 -0.682569D+01
               131           132           133           134           135 
      1  -0.590970D+01  0.388907D+01  0.275556D+01  0.445179D+01 -0.432346D+01
      2  -0.344192D+01  0.565645D+01  0.124609D+01  0.257819D+01 -0.490494D+01
      3  -0.113885D+02  0.615862D+01  0.411828D+01  0.438640D+01 -0.583840D+01
               136           137           138           139           140 
      1   0.592168D+00 -0.445931D+00 -0.210397D+01 -0.289808D+01 -0.285659D+01
      2  -0.931134D+00 -0.619968D+00  0.396386D+01  0.345494D+01 -0.314006D+00
      3  -0.450417D+00 -0.415424D+01  0.131093D+00 -0.754210D+00 -0.888585D+01
               141           142           143           144           145 
      1  -0.212392D+01 -0.123159D+01 -0.283091D+00  0.135869D+01  0.410615D+01
      2   0.347833D+01  0.104539D+01  0.285066D+01 -0.227298D+01 -0.252446D+01
      3   0.390944D+01 -0.166007D+01  0.258725D+01 -0.102048D+01  0.712308D+01
               146           147           148           149           150 
      1  -0.176056D+01 -0.247771D+01 -0.287403D+01  0.595917D+01  0.374217D+01
      2  -0.234333D+00  0.368823D+01 -0.795026D+00 -0.364607D+01 -0.597625D+01
      3  -0.613526D+01 -0.417672D+01 -0.665734D+01  0.119654D+02  0.634501D+01
               151           152           153           154           155 
      1  -0.250522D+01  0.444688D+01  0.408939D+01 -0.981605D+00  0.196281D+01
      2   0.124006D+01 -0.282463D+01 -0.507377D+01 -0.357384D+01 -0.160521D+01
      3  -0.391829D+01  0.456940D+01  0.583165D+01  0.801635D+01 -0.434746D+01
               156           157           158           159           160 
      1  -0.276459D+01 -0.264225D+00 -0.112946D+01 -0.924449D+00 -0.196661D+01
      2   0.492114D+01  0.245451D+01  0.198668D+01  0.150909D+01  0.219392D+01
      3   0.341480D+01 -0.944412D+00  0.602231D+00 -0.193276D+01  0.128975D+01
               161           162           163           164           165 
      1   0.115748D+01 -0.131779D+01 -0.128124D+01 -0.142819D+01  0.163278D+01
      2   0.348331D+00  0.256525D+01  0.494340D+01 -0.229069D+01 -0.347948D+01
      3  -0.289185D+01  0.101243D+01 -0.501844D+01  0.539404D+01  0.338766D+01
               166           167           168           169           170 
      1  -0.273231D+00  0.183529D+01 -0.288878D+01  0.179474D+00  0.386137D+00
      2  -0.146469D+01  0.689755D+01  0.678164D+01 -0.307461D+01  0.511825D+01
      3   0.469325D+01 -0.136224D+02 -0.684532D+01  0.159315D+01 -0.562298D+01
               171           172           173           174           175 
      1  -0.196521D+01 -0.226606D+01  0.292860D+01 -0.223525D+00  0.450672D+01
      2   0.623495D+01 -0.183755D+01  0.188332D+01  0.193392D+01  0.543273D+01
      3  -0.584543D+01  0.289572D+01 -0.504699D+01  0.342411D+00 -0.419293D+01
               176           177           178           179           180 
      1  -0.767407D+01  0.244792D+00  0.143930D+01 -0.622653D+00 -0.332411D+00
      2  -0.167878D+01  0.117896D+00  0.378442D+01 -0.110706D+01  0.899893D+00
      3   0.105061D+02 -0.145637D+01 -0.708132D+00  0.216300D+01  0.541346D+00
               181           182           183           184           185 
      1  -0.209788D+01 -0.817054D+00 -0.940341D+00  0.204979D-01 -0.675348D+00
      2   0.267299D+00  0.836823D+00 -0.352900D+01 -0.649455D+00  0.192046D+01
      3   0.166546D+01  0.315784D-01  0.392342D+00  0.659487D+00  0.652775D+00
               186           187           188           189           190 
      1   0.762804D+00  0.103302D+01  0.287448D+01 -0.478372D+00  0.568407D+00
      2  -0.498104D+00  0.261373D+00 -0.243280D+01  0.164022D+02 -0.310502D+01
      3  -0.170525D+01 -0.141721D+01 -0.251466D+01  0.172497D+01 -0.396013D+01
               191           192           193           194           195 
      1   0.486316D+01 -0.952886D+00  0.119204D+01 -0.748596D+01 -0.120803D+01
      2   0.220488D+01  0.117177D+00  0.276952D+01 -0.336787D+01  0.138938D+01
      3   0.499129D+01 -0.170522D+01  0.557010D+01 -0.927280D+01  0.143533D+01
               196           197           198           199           200 
      1  -0.800292D+00 -0.355508D+01  0.167454D+00  0.445475D+00 -0.138815D+01
      2  -0.318256D-01  0.826425D+00 -0.730243D+00 -0.179162D+01  0.423968D+00
      3   0.105569D+01 -0.136730D+01 -0.690677D+00 -0.114366D+01 -0.101570D+01
               201           202           203           204           205 
      1   0.138655D+01 -0.850982D+00 -0.173812D+00  0.305376D+01 -0.276493D+00
      2  -0.116796D+01 -0.923836D+00 -0.140970D+01 -0.614648D+00 -0.313302D+01
      3  -0.124334D+01 -0.365631D+00 -0.113799D+01  0.127346D+01 -0.284975D+01
               206           207           208           209           210 
      1  -0.953004D+00  0.134922D+02 -0.420825D+00  0.511194D+01  0.881126D+00
      2   0.138883D+01 -0.935060D+01 -0.333778D+01 -0.242206D+01  0.363719D-01
      3   0.152968D+00 -0.150654D+01  0.448831D+01  0.518340D+01  0.174836D+01
               211           212           213           214           215 
      1   0.140862D+01  0.705469D+01 -0.131929D+01  0.643575D+00 -0.364511D+01
      2  -0.283474D+01 -0.345250D+01 -0.133701D+01 -0.775260D-01 -0.660233D+00
      3   0.579825D+01  0.880474D+01  0.134944D+01 -0.112321D+01 -0.132539D+01
               216           217           218           219           220 
      1  -0.199324D+00 -0.619092D+00 -0.138278D+01 -0.130817D+01 -0.771486D+00
      2  -0.726284D+00 -0.174497D+01 -0.349884D+00 -0.108609D+01  0.975173D+00
      3   0.686453D+00  0.108834D+01 -0.101156D+01  0.130176D+01 -0.362569D+00
               221           222           223           224           225 
      1   0.210448D+00  0.311018D+01  0.947785D-01 -0.105067D+01 -0.138827D+02
      2  -0.144787D+01  0.517761D+00 -0.318327D+01 -0.122166D+01 -0.874919D+01
      3   0.120149D+01  0.121608D+01  0.285428D+01  0.325650D-01  0.152577D+01
               226           227           228           229           230 
      1   0.245572D+01  0.310029D+01  0.276176D+00  0.448009D+01  0.729151D+01
      2  -0.223069D+01 -0.204215D+01  0.195147D+01 -0.559734D+01 -0.171003D+01
      3  -0.324369D+01 -0.538861D+01 -0.350465D+00 -0.450147D+01 -0.101145D+02
               231           232           233           234           235 
      1   0.218315D+00 -0.130884D+01 -0.502047D+00  0.356385D+00  0.205858D+01
      2  -0.190680D+00  0.389219D+01  0.967750D+00  0.891289D+00  0.173990D+00
      3  -0.142062D+01  0.822720D+00  0.212937D+01 -0.535157D+00 -0.162979D+01
               236           237           238           239           240 
      1  -0.903539D+00  0.824237D+00 -0.119921D-01  0.793514D+00  0.747257D+00
      2  -0.718987D+00 -0.354542D+01  0.731513D+00  0.189727D+01  0.616348D+00
      3   0.752333D-01 -0.467120D+00  0.706712D+00 -0.679666D+00 -0.168650D+01
               241           242           243           244           245 
      1  -0.893138D+00  0.300906D+01  0.118213D+01 -0.797336D+01  0.399847D+01
      2   0.413993D+00  0.228972D+01  0.163565D+02 -0.173736D+01 -0.980344D+00
      3   0.130938D+01 -0.257589D+01 -0.172062D+01  0.742742D+01 -0.170908D+01
               246           247           248           249           250 
      1  -0.750712D+01  0.533841D+01  0.928738D+01 -0.492432D+01 -0.587303D+01
      2   0.482010D-01 -0.179654D-01  0.228371D+01  0.712388D+00 -0.338896D+01
      3   0.604580D+01  0.451188D+01 -0.102025D+01 -0.750438D+01  0.109814D+02
               251           252           253           254           255 
      1  -0.274382D+01 -0.166149D+01  0.451083D+01  0.294328D+01 -0.103070D+01
      2  -0.111518D+00 -0.369915D+00 -0.134524D+02  0.137962D+02  0.135456D+02
      3  -0.816001D+01  0.617882D+01  0.182182D+02 -0.229235D+02 -0.141495D+02
               256           257           258           259           260 
      1   0.813592D+00 -0.144042D+02  0.401275D+01 -0.699044D+01  0.233347D+02
      2   0.521231D+01 -0.265597D+00  0.320911D+01 -0.162495D+01  0.122661D+02
      3  -0.421261D+01 -0.973713D+01  0.905094D+00 -0.751316D+01 -0.116747D+01
               261           262           263           264           265 
      1   0.145463D+02  0.552369D+01 -0.347283D+01 -0.389794D+01 -0.183471D+01
      2   0.106479D+02  0.741169D+01  0.680320D+00 -0.161329D+01 -0.237927D+01
      3  -0.279105D+01  0.127171D+02 -0.293864D+01 -0.570689D+01 -0.343484D+01
               266           267           268           269           270 
      1   0.279461D+01  0.335792D-01 -0.323051D+01  0.121508D+01  0.297624D+01
      2  -0.921262D+00  0.837684D+00 -0.885858D+00  0.243634D+00  0.353783D+00
      3   0.202753D+01  0.177694D+01 -0.263144D+01 -0.887599D-01  0.314894D+01
               271           272           273           274           275 
      1   0.135170D+01  0.821129D+00  0.397988D+01 -0.582442D+00  0.275219D+00
      2  -0.144291D+01  0.323546D+01 -0.509202D+01  0.128258D+01  0.519273D+00
      3  -0.473083D+00  0.302345D+01 -0.332250D+01  0.189739D+01  0.100032D+01
               276           277           278           279           280 
      1  -0.398165D+00  0.808710D+00  0.206956D+00  0.950868D+01 -0.688988D+01
      2  -0.203251D+00 -0.284328D+01  0.227211D+01 -0.836283D+01  0.256693D+01
      3   0.372916D+00 -0.135607D+01  0.211426D+01 -0.249833D+01  0.143250D+02
               281           282           283           284           285 
      1  -0.142548D+01 -0.552707D+01 -0.474380D+00 -0.125424D+01 -0.860213D+00
      2   0.567790D+00  0.363919D+01  0.693109D-01  0.520309D+00  0.958608D-01
      3  -0.733630D+00  0.587815D+01 -0.514684D-01  0.481870D+01 -0.313265D+00
               286           287           288           289           290 
      1  -0.648054D+01 -0.905763D+00 -0.884429D+01  0.628964D-01  0.294441D+00
      2   0.134817D+01  0.138103D+01  0.342068D+01  0.181901D+00  0.354070D+00
      3   0.984189D+01 -0.281891D+00  0.517729D+01  0.214140D+01  0.372596D+01
               291           292           293           294           295 
      1  -0.174805D+01  0.163784D+01  0.353983D+01 -0.696532D+01 -0.144094D+01
      2   0.745619D+00  0.250493D+00 -0.171284D+01  0.169921D+01 -0.810986D+00
      3  -0.108465D+01  0.507274D+01 -0.312017D+01  0.167620D+00 -0.728350D+00
               296           297           298           299           300 
      1  -0.147716D+01  0.680608D+01  0.211459D-01  0.115139D+00  0.146518D+01
      2   0.158823D+01 -0.170779D+01  0.151260D+00 -0.442314D+00  0.604525D+00
      3   0.403886D+01  0.234608D+00 -0.174257D+01  0.394426D+01  0.109207D+01
               301           302           303           304           305 
      1   0.146519D+01 -0.368998D+01 -0.710664D+01  0.133522D+01 -0.161026D+01
      2  -0.397288D+00 -0.151840D+01 -0.141643D+01 -0.939440D+00 -0.147865D+01
      3   0.529051D+01  0.271704D+01  0.115793D+00  0.905467D+00  0.400073D+01
               306           307           308           309           310 
      1  -0.687399D+01  0.689616D+01 -0.170517D+01  0.563571D+01 -0.723037D+00
      2  -0.140440D+01  0.223171D+01 -0.582659D+00  0.338158D+01 -0.121578D+00
      3  -0.235801D+00 -0.143440D+02 -0.300660D+00 -0.588403D+01  0.379345D+00
               311           312           313           314           315 
      1   0.137221D+01 -0.111892D+01  0.647828D+01 -0.124892D+01  0.898369D+01
      2   0.488193D+00 -0.212635D+00  0.996013D+00 -0.138183D+01  0.302315D+01
      3  -0.480051D+01 -0.509553D-01 -0.983934D+01  0.162000D+00 -0.517453D+01
               316           317           318           319           320 
      1  -0.541360D+01 -0.338075D+01  0.381882D+01 -0.161482D+01 -0.259956D+01
      2   0.770591D+01 -0.912512D+00 -0.182099D+01  0.206963D+01 -0.873127D+00
      3  -0.129718D+02 -0.244264D+01  0.579022D+01 -0.294788D+01 -0.176170D+01
               321           322           323           324           325 
      1  -0.173072D+00  0.323551D+01  0.105531D+01 -0.296406D+01 -0.140546D+01
      2  -0.759471D+00 -0.105436D+01 -0.259531D+00  0.475339D+00 -0.155083D+01
      3   0.152767D+01  0.263057D+01 -0.200713D+00 -0.314536D+01  0.685292D+00
               326           327           328           329           330 
      1   0.713621D+00 -0.421499D+01 -0.594012D+00 -0.240911D+00 -0.194783D+00
      2  -0.318013D+01 -0.488332D+01 -0.118052D+01  0.731873D+00  0.430636D+00
      3   0.294763D+01  0.333130D+01  0.182071D+01 -0.120685D+01  0.227594D+00
               331           332           333 
      1  -0.912307D+00  0.138946D+00 -0.985255D+01
      2  -0.287729D+01 -0.216284D+01 -0.791961D+01
      3   0.141878D+01  0.206753D+01  0.249011D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.457232D+02 -0.788864D+01 -0.259632D+02 -0.241015D+01  0.188425D+02
      2   0.290650D+02  0.936601D+01  0.142911D+02  0.633053D+01 -0.965375D+01
      3   0.166582D+02 -0.147737D+01  0.116721D+02 -0.392037D+01 -0.918871D+01
      4  -0.190022D+02  0.889606D+01 -0.923130D+01  0.115709D+02  0.568577D+01
      5  -0.291721D+02 -0.238235D+01 -0.581184D+01  0.344774D+01 -0.886152D+01
      6  -0.803832D+01  0.595240D+01 -0.710277D-01  0.426090D+01 -0.958678D+01
                 6             7             8             9            10 
      1   0.752331D+01 -0.197801D+02  0.612703D+01 -0.951150D+00  0.105858D+02
      2  -0.998041D+01  0.113589D+02 -0.817091D+01 -0.358974D+01 -0.718964D+01
      3   0.245710D+01  0.842118D+01  0.204388D+01  0.454089D+01 -0.339619D+01
      4  -0.864999D+01 -0.442171D+01 -0.626088D+01 -0.432861D+01 -0.168448D+01
      5  -0.498997D+01 -0.678143D+01 -0.381015D+01  0.367393D+01  0.118477D+02
      6  -0.975677D+01 -0.216188D+00 -0.780114D+01  0.116406D+00  0.917360D+01
                11            12            13            14            15 
      1   0.221301D+01  0.145439D+02  0.210395D+00 -0.180947D+02 -0.276285D+01
      2  -0.112404D+02 -0.564594D+01 -0.120025D+02  0.415714D+01  0.106657D+02
      3   0.902738D+01 -0.889799D+01  0.117921D+02  0.139376D+02 -0.790285D+01
      4  -0.238584D+02  0.762211D+01 -0.295110D+02 -0.259391D+02  0.197513D+02
      5   0.215676D+00 -0.962693D+01  0.202069D+01  0.222885D+02  0.394308D+01
      6   0.528148D+01 -0.100028D+01  0.110286D+02  0.127442D+02 -0.307546D+01
                16            17            18            19            20 
      1   0.984582D+01 -0.445625D+01 -0.587535D+01  0.836697D+00  0.319048D+01
      2  -0.310100D+01  0.994698D+01  0.230114D+01 -0.445968D+01  0.187004D+01
      3  -0.674482D+01 -0.549073D+01  0.357421D+01  0.362298D+01 -0.506051D+01
      4   0.469019D+01  0.145416D+02  0.446743D+00  0.776624D+01  0.142325D+02
      5  -0.863359D+01  0.216253D+01 -0.289044D+01 -0.423643D+01 -0.275847D+01
      6  -0.153969D+01 -0.420933D+01 -0.326857D+01 -0.827590D+01 -0.678707D+01
                21            22            23            24            25 
      1  -0.714705D+01 -0.137811D+01  0.160189D+02 -0.838991D+00 -0.175100D+01
      2   0.465021D+01  0.408653D+01 -0.195788D+02  0.264900D+01  0.199696D+01
      3   0.249685D+01 -0.270842D+01  0.355986D+01 -0.181001D+01 -0.245958D+00
      4  -0.934350D+01  0.912136D+01  0.908006D+01 -0.522645D+01 -0.496382D+01
      5   0.484571D+01 -0.115742D+01 -0.705250D+01  0.279960D+01  0.515437D+01
      6   0.247018D+01 -0.688029D+01 -0.554429D+00  0.535823D+01  0.100013D+01
                26            27            28            29            30 
      1  -0.180000D+01  0.110935D+02 -0.103912D+02  0.769287D-01  0.468448D+01
      2   0.136469D+01  0.496684D+01  0.270271D+01 -0.657527D-01 -0.602390D+01
      3   0.435309D+00 -0.160604D+02  0.768852D+01 -0.111759D-01  0.133942D+01
      4  -0.218761D+01  0.180556D+01  0.417471D-01 -0.565797D+01 -0.359731D+00
      5   0.473387D+00  0.616105D+01  0.298134D+01 -0.214157D+00 -0.256676D+01
      6   0.355136D+01  0.617907D+01 -0.205038D+00 -0.348997D+01  0.302000D-03
                31            32            33            34            35 
      1  -0.270504D-01  0.217806D+01 -0.372600D+00  0.835275D+01 -0.554336D+00
      2   0.320113D-01 -0.916591D+01  0.411679D+00 -0.913747D+01  0.579513D+00
      3  -0.496092D-02  0.698785D+01 -0.390786D-01  0.784711D+00 -0.251770D-01
      4  -0.703821D+01 -0.868780D-02 -0.615985D+01 -0.581470D+00 -0.882394D+01
      5  -0.204144D+00 -0.366740D+01  0.106348D-01  0.482045D+01 -0.178010D-01
      6  -0.339020D+01  0.245754D+00 -0.211563D+01 -0.148700D-01  0.370923D+01
                36            37            38            39            40 
      1  -0.455512D+00  0.158538D+00 -0.131679D+01 -0.628862D+01  0.281165D+01
      2  -0.558318D+00 -0.410914D+01 -0.374154D+01  0.373150D+01 -0.551866D+01
      3   0.101383D+01  0.395060D+01  0.505833D+01  0.255712D+01  0.270701D+01
      4   0.354814D-02 -0.697651D+01  0.140725D+02  0.956055D+01  0.867268D+01
      5   0.967300D+00 -0.373066D+01  0.230402D+01  0.461203D+01  0.701271D+00
      6  -0.314428D-01  0.782754D+01 -0.717446D+01 -0.244405D+01 -0.720291D+01
                41            42            43            44            45 
      1   0.151048D+02  0.650156D+00 -0.124775D+01  0.166125D+01  0.109460D+02
      2  -0.183378D+02 -0.229710D+01  0.152870D+01 -0.118174D+01  0.511195D+01
      3   0.323309D+01  0.164694D+01 -0.280958D+00 -0.479513D+00 -0.160580D+02
      4  -0.116013D+02 -0.577059D+01  0.501848D+01 -0.253437D+01 -0.205207D+01
      5  -0.715397D+01 -0.273477D+01  0.508517D+01 -0.509462D+00  0.587258D+01
      6   0.151629D+01  0.558209D+01 -0.106965D+01  0.359982D+01 -0.648471D+01
                46            47            48            49            50 
      1   0.104005D+02 -0.536385D+01  0.140048D+02 -0.384442D+01 -0.154016D+02
      2  -0.611926D+01  0.136188D+02 -0.548975D+01  0.148766D+02  0.584941D+00
      3  -0.428125D+01 -0.825500D+01 -0.851510D+01 -0.110322D+02  0.148167D+02
      4  -0.131205D+01 -0.219550D+02 -0.761178D+01 -0.276290D+02  0.290530D+02
      5   0.113712D+02  0.475937D+00 -0.975527D+01 -0.107390D+01  0.217368D+02
      6  -0.896480D+01  0.506429D+01  0.129292D+01  0.108807D+02 -0.144056D+02
                51            52            53            54            55 
      1   0.384914D+01  0.963861D+01  0.528130D+01 -0.592526D+01 -0.433529D+02
      2  -0.121412D+02 -0.316583D+01 -0.110613D+02  0.236263D+01  0.265060D+02
      3   0.829203D+01 -0.647278D+01  0.578000D+01  0.356263D+01  0.168469D+02
      4   0.194199D+02 -0.460141D+01  0.140490D+02 -0.123354D+00  0.228938D+02
      5  -0.369914D+01 -0.865311D+01 -0.202108D+01 -0.271434D+01 -0.287573D+02
      6  -0.293757D+01  0.172571D+01 -0.415861D+01  0.339931D+01  0.969023D+01
                56            57            58            59            60 
      1   0.112323D+02 -0.254031D+02  0.597785D+01  0.176505D+02 -0.717071D+01
      2  -0.115980D+02  0.138528D+02 -0.879664D+01 -0.826909D+01  0.101086D+02
      3   0.365643D+00  0.115503D+02  0.281879D+01 -0.938142D+01 -0.293790D+01
      4   0.683903D+01  0.105496D+02  0.989188D+01 -0.767675D+01 -0.831173D+01
      5   0.348791D+01 -0.556456D+01 -0.242045D+01 -0.844409D+01  0.481543D+01
      6   0.585629D+01 -0.128974D+00  0.442410D+01  0.951587D+01 -0.997415D+01
                61            62            63            64            65 
      1  -0.195700D+02 -0.581627D+01 -0.532426D+00  0.106460D+02 -0.689262D+01
      2   0.112660D+02  0.819947D+01 -0.399111D+01 -0.101905D+02  0.600522D+01
      3   0.830401D+01 -0.238320D+01  0.452353D+01 -0.455438D+00  0.887402D+00
      4   0.546487D+01 -0.585432D+01  0.419336D+01 -0.209968D+02 -0.611230D+01
      5  -0.657022D+01  0.376705D+01  0.365507D+01  0.115762D+02 -0.527973D+01
      6   0.145598D+00 -0.799052D+01 -0.251562D+00 -0.373209D+01 -0.467299D+01
                66            67            68            69            70 
      1   0.658692D+01 -0.112154D+02 -0.876806D+01 -0.376003D+01  0.378237D+01
      2  -0.658655D+01  0.788839D+01  0.142126D+01  0.175155D+01 -0.296268D+01
      3  -0.373447D-03  0.332706D+01  0.734680D+01  0.200848D+01 -0.819687D+00
      4  -0.886079D+01  0.720805D-01 -0.462363D+01  0.688345D+01 -0.455119D+01
      5   0.801617D+01 -0.605421D+01  0.219791D+01 -0.159893D+01  0.469820D+01
      6  -0.144708D+01 -0.250148D+01 -0.203383D+01  0.318839D+01 -0.127956D+01
                71            72            73            74            75 
      1  -0.136495D+01  0.910042D+01  0.131315D+02  0.544438D+01  0.751564D+01
      2   0.299574D+01  0.819266D+01 -0.125181D+02 -0.489334D+01 -0.742679D+01
      3  -0.163080D+01 -0.172931D+02 -0.613350D+00 -0.551042D+00 -0.888478D-01
      4   0.237882D+01 -0.486969D+01  0.196786D+02 -0.728549D+01  0.854232D+01
      5  -0.205973D+01 -0.871320D+01  0.121926D+02  0.465859D+01  0.814665D+01
      6   0.374790D+01  0.818137D+00  0.291296D+01 -0.495000D+01  0.123295D+01
                76            77            78            79            80 
      1   0.103038D+02 -0.910319D+01  0.403655D+01  0.425534D+01  0.137221D+01
      2  -0.730841D+01  0.158707D+01 -0.202731D+01 -0.349537D+01 -0.303679D+01
      3  -0.299539D+01  0.751612D+01 -0.200924D+01 -0.759980D+00  0.166458D+01
      4  -0.140959D+01  0.538002D+01  0.625695D+01  0.431883D+01  0.199455D+01
      5   0.553078D+01  0.181427D+01  0.139022D+01  0.486648D+01  0.202063D+01
      6  -0.281190D+01  0.226421D+01  0.306900D+01  0.123798D+01  0.361118D+01
                81            82            83            84            85 
      1   0.954015D+01 -0.802273D+01 -0.373791D+01  0.108656D+02 -0.659616D+01
      2   0.776816D+01  0.111203D+02  0.366332D+01 -0.347135D+01  0.101577D+02
      3  -0.173083D+02 -0.309759D+01  0.745945D-01 -0.739421D+01 -0.356156D+01
      4   0.481939D+01 -0.688223D+01  0.222046D+01  0.585035D+01  0.199120D+01
      5  -0.875209D+01  0.957023D+01 -0.125014D+01 -0.260051D+01 -0.155850D+01
      6  -0.452263D+00  0.572905D+01 -0.465980D+01  0.497066D+01 -0.349715D+01
                86            87            88            89            90 
      1  -0.183561D+02  0.893794D+01  0.715536D+01  0.451934D+01  0.335241D+01
      2   0.189158D+02 -0.170624D+02 -0.931347D-01 -0.842046D+01  0.558909D+01
      3  -0.559739D+00  0.812444D+01 -0.706222D+01  0.390112D+01 -0.894150D+01
      4   0.513009D+01 -0.355395D+01  0.644667D+01 -0.272157D+01  0.299120D+01
      5  -0.751404D+01  0.192366D+01 -0.141636D+01  0.490063D+00 -0.188516D+01
      6  -0.130627D+02  0.475489D+01  0.386748D+01  0.196406D+01  0.733942D+01
                91            92            93            94            95 
      1  -0.210463D+01  0.198156D+01 -0.703070D+01  0.758993D+01  0.182864D+02
      2  -0.163480D+00 -0.361218D+01  0.437145D+01 -0.135598D+02 -0.246536D+02
      3   0.226811D+01  0.163062D+01  0.265925D+01  0.596987D+01  0.636723D+01
      4  -0.693267D+01 -0.350095D+01 -0.128570D+02 -0.468936D+01 -0.122799D+02
      5  -0.591085D+01 -0.161273D+01 -0.346066D+01 -0.116528D+01  0.753181D+01
      6  -0.130704D+02  0.372413D+01 -0.886830D+01  0.451398D+01  0.312821D+02
                96            97            98            99           100 
      1  -0.165140D+02 -0.986630D+01 -0.215019D+02  0.308474D+01  0.723734D+02
      2   0.314146D+02  0.812954D+01  0.350620D+02 -0.763087D+01 -0.391025D+02
      3  -0.149006D+02  0.173676D+01 -0.135602D+02  0.454613D+01 -0.332709D+02
      4   0.597974D+01 -0.142463D+02  0.928159D+01 -0.122190D+02 -0.333351D+02
      5  -0.520012D+00 -0.486513D+01 -0.364931D+01 -0.245470D+00  0.331452D+02
      6  -0.102156D+02 -0.120818D+02 -0.136793D+02  0.200048D+01 -0.101145D+02
               101           102           103           104           105 
      1  -0.104553D+02  0.202226D+02  0.211818D+01  0.556317D+01  0.228313D+01
      2   0.312466D+01 -0.133059D+02 -0.475975D+01 -0.172183D+01 -0.344933D+01
      3   0.733060D+01 -0.691661D+01  0.264157D+01 -0.384134D+01  0.116620D+01
      4   0.137817D+02 -0.960886D+01  0.105097D+02 -0.548825D+01  0.418962D+01
      5  -0.540408D+01  0.186802D+02  0.723305D+00  0.519318D+01 -0.685509D+00
      6   0.336334D+01 -0.658959D+01  0.289929D+01 -0.318650D+01  0.369672D+01
               106           107           108           109           110 
      1   0.154710D+02 -0.979109D+00  0.114020D+02 -0.238578D+01 -0.945847D+01
      2  -0.124396D+02 -0.431697D+00 -0.930930D+01  0.260022D+01  0.863855D+01
      3  -0.303135D+01  0.141081D+01 -0.209275D+01 -0.214436D+00  0.819918D+00
      4  -0.883648D+01  0.460050D+01 -0.741323D+01 -0.573229D+00 -0.101621D+01
      5   0.216280D+02 -0.447935D+01  0.136891D+02  0.330789D+01 -0.638204D+00
      6  -0.749863D+01  0.458324D+01 -0.489055D+01 -0.519776D+01 -0.590685D+01
               111           112           113           114           115 
      1   0.899040D+01 -0.552386D+01 -0.192560D+02  0.998006D+01  0.579907D+01
      2  -0.495482D+01  0.353306D+01  0.243716D+02 -0.933570D+01 -0.264187D+01
      3  -0.403558D+01  0.199080D+01 -0.511561D+01 -0.644356D+00 -0.315721D+01
      4  -0.203474D+01  0.475487D+01 -0.147408D+02  0.711066D+01 -0.467497D+01
      5  -0.828244D+00 -0.211420D+01  0.729770D+01 -0.890986D+01  0.334737D+01
      6   0.526312D+01 -0.454977D+00 -0.183494D+02  0.144969D+02  0.330043D+00
               116           117           118           119           120 
      1   0.772676D+01 -0.977373D+01  0.151324D+02 -0.100234D+02 -0.545645D+01
      2  -0.589623D+01  0.473474D+01 -0.412311D+00 -0.300213D+01  0.122928D+01
      3  -0.183053D+01  0.503899D+01 -0.147201D+02  0.130255D+02  0.422718D+01
      4   0.717815D+01 -0.548456D+01 -0.253635D+02  0.240942D+02  0.816116D+01
      5  -0.669233D+01  0.808863D+01 -0.113116D+02  0.759914D+01  0.897925D+01
      6   0.131573D+02 -0.133510D+02  0.749829D+01 -0.599660D+01 -0.478500D+01
               121           122           123           124           125 
      1  -0.911685D+01  0.603065D+00 -0.116806D+01 -0.391380D+01 -0.142426D+01
      2  -0.904886D+01  0.242746D+02  0.682004D+01  0.109368D+01  0.367302D+01
      3   0.181657D+02 -0.248776D+02 -0.565199D+01  0.282012D+01 -0.224876D+01
      4   0.346429D+02 -0.471851D+02 -0.160525D+02  0.937388D+01 -0.125750D+02
      5   0.106057D+02 -0.159844D+02 -0.103746D+02  0.121449D+02 -0.112163D+02
      6  -0.109129D+02  0.184796D+02  0.115871D+02 -0.839019D+01  0.124976D+02
               126           127           128           129           130 
      1   0.103717D+01  0.227073D+02  0.754372D+01 -0.101980D+02  0.158019D+02
      2   0.148293D+01 -0.162951D+02 -0.693884D+01  0.849269D+01 -0.135868D+02
      3  -0.252009D+01 -0.641219D+01 -0.604874D+00  0.170532D+01 -0.221513D+01
      4  -0.120515D+02  0.177340D+01  0.693398D+01 -0.361346D-01  0.700003D+01
      5  -0.918142D+01 -0.154748D+02 -0.397041D+01  0.128561D+02 -0.929837D+01
      6   0.874398D+01  0.110335D+01 -0.181954D+01 -0.206788D+01 -0.280093D+01
               131           132           133           134           135 
      1   0.898120D+01 -0.559399D+01 -0.988178D+01 -0.158493D+01  0.661244D+01
      2  -0.820085D+01  0.874282D+01  0.951401D+01  0.493593D+01 -0.108595D+02
      3  -0.780348D+00 -0.314883D+01  0.367769D+00 -0.335099D+01  0.424710D+01
      4   0.834286D+01 -0.732267D+01  0.176062D+01 -0.601386D+01  0.257850D+01
      5  -0.103059D+02  0.117607D+02  0.137229D+02  0.557677D+01 -0.151110D+02
      6  -0.160209D+01  0.382251D+00 -0.148926D+01  0.251312D+01  0.131811D+01
               136           137           138           139           140 
      1   0.183552D+02  0.115115D+02 -0.616812D+01  0.115410D+02  0.373106D+01
      2  -0.225708D+01  0.189039D+01  0.169282D+01  0.700158D+01  0.197570D+02
      3  -0.160981D+02 -0.134019D+02  0.447530D+01 -0.185426D+02 -0.234881D+02
      4   0.271643D+02  0.245986D+02 -0.855290D+01  0.354149D+02  0.454391D+02
      5  -0.124766D+02 -0.804960D+01  0.965202D+01 -0.112726D+02 -0.159544D+02
      6  -0.772599D+01 -0.610255D+01  0.487503D+01 -0.108887D+02 -0.170535D+02
               141           142           143           144           145 
      1   0.214756D-01 -0.471419D+01  0.520793D+00  0.208907D+01  0.215510D+02
      2  -0.548607D+01  0.178926D+01 -0.264964D+01  0.430069D+00 -0.152447D+02
      3   0.546459D+01  0.292493D+01  0.212885D+01 -0.251913D+01 -0.630633D+01
      4  -0.159961D+02 -0.969075D+01 -0.123624D+02  0.120422D+02 -0.279041D+01
      5   0.104751D+02  0.130178D+02  0.112133D+02 -0.957366D+01 -0.149326D+02
      6   0.109330D+02  0.838150D+01  0.116563D+02 -0.835364D+01 -0.647342D+00
               146           147           148           149           150 
      1  -0.750869D+01 -0.993614D+01 -0.157640D+02  0.923897D+01  0.537623D+01
      2   0.665690D+01  0.808506D+01  0.132834D+02 -0.831491D+01 -0.843567D+01
      3   0.851796D+00  0.185108D+01  0.248062D+01 -0.924056D+00  0.305944D+01
      4   0.728280D+01  0.502591D+00  0.799618D+01 -0.975955D+01 -0.795118D+01
      5   0.409312D+01  0.124069D+02  0.938212D+01 -0.108078D+02 -0.122723D+02
      6  -0.188070D+01  0.154508D+01 -0.309358D+01  0.227417D+01  0.830366D+00
               151           152           153           154           155 
      1  -0.994132D+01  0.148259D+01  0.635906D+01  0.753322D+02  0.865341D+01
      2   0.941993D+01 -0.480948D+01 -0.105762D+02 -0.416920D+02 -0.259500D+01
      3   0.521393D+00  0.332688D+01  0.421710D+01 -0.336401D+02 -0.605841D+01
      4  -0.118584D+01 -0.622758D+01 -0.332563D+01  0.294291D+02  0.121141D+02
      5   0.135127D+02 -0.604760D+01 -0.151102D+02  0.337346D+02  0.433744D+01
      6   0.100653D+01  0.271589D+01 -0.649765D+00  0.894538D+01  0.287681D+01
               156           157           158           159           160 
      1   0.209018D+02 -0.416040D+01  0.569610D+01 -0.280758D+01  0.162582D+02
      2  -0.139329D+02  0.553181D+01 -0.222327D+01  0.368047D+01 -0.131542D+02
      3  -0.696887D+01 -0.137141D+01 -0.347283D+01 -0.872880D+00 -0.310396D+01
      4   0.833070D+01  0.973486D+01  0.418785D+01  0.407601D+01  0.782145D+01
      5   0.189871D+02 -0.180562D+01  0.517182D+01  0.361616D-01  0.221440D+02
      6   0.594297D+01  0.267701D+01  0.271930D+01  0.341527D+01  0.676003D+01
               161           162           163           164           165 
      1   0.686206D+00  0.120188D+02 -0.171449D+01  0.865298D+01  0.873197D+01
      2   0.599115D+00 -0.992415D+01  0.206216D+01 -0.763098D+01 -0.473006D+01
      3  -0.128532D+01 -0.209464D+01 -0.347674D+00 -0.102200D+01 -0.400191D+01
      4   0.424119D+01  0.651052D+01  0.918242D+00 -0.112168D+01  0.176750D+01
      5   0.373689D+01  0.139151D+02  0.363880D+01  0.577414D+00 -0.640885D+00
      6   0.410491D+01  0.430992D+01  0.480306D+01 -0.536426D+01 -0.460607D+01
               166           167           168           169           170 
      1   0.525142D+01 -0.185481D+02 -0.970834D+01  0.588768D+01 -0.733460D+01
      2  -0.304818D+01  0.235506D+02  0.890171D+01 -0.280648D+01  0.537702D+01
      3  -0.220324D+01 -0.500256D+01  0.806630D+00 -0.308120D+01  0.195757D+01
      4   0.504353D+01  0.164392D+02  0.784108D+01  0.462917D+01  0.753819D+01
      5   0.229419D+01  0.795880D+01  0.955620D+01  0.364152D+01  0.709513D+01
      6   0.149479D-01  0.182730D+02  0.143019D+02  0.773212D-01  0.128562D+02
               171           172           173           174           175 
      1  -0.925626D+01  0.130609D+02 -0.631435D+01  0.497165D+00 -0.119906D+02
      2   0.423894D+01 -0.487771D+01  0.234501D+01 -0.852873D+00  0.653818D+01
      3   0.501732D+01 -0.818318D+01  0.396934D+01  0.355707D+00  0.545237D+01
      4   0.608287D+01 -0.112372D+02  0.116732D+02 -0.248540D+01  0.954531D+01
      5   0.863582D+01  0.367495D+01 -0.302446D+01  0.331030D+01 -0.861364D+01
      6   0.129666D+02 -0.316376D+01  0.380691D+01 -0.136057D+01  0.450909D+01
               176           177           178           179           180 
      1   0.456057D+01 -0.255577D+01 -0.613836D+01  0.111865D+01 -0.103557D+01
      2   0.804855D+00  0.394364D+01  0.297206D+01  0.817183D+00 -0.829996D+00
      3  -0.536542D+01 -0.138787D+01  0.316631D+01 -0.193583D+01  0.186556D+01
      4  -0.181700D+02  0.204344D+01 -0.196669D+01 -0.227124D+01 -0.386893D+01
      5   0.318083D+01 -0.581190D+01  0.349901D+00 -0.310998D+01  0.838774D+00
      6  -0.686029D+01  0.218249D+01 -0.123613D+01  0.961142D+00 -0.172737D+01
               181           182           183           184           185 
      1  -0.337881D+01 -0.195136D+00  0.357826D+01  0.210872D+00 -0.120802D+01
      2   0.919239D+00 -0.561236D+00  0.169101D+01 -0.122722D+00 -0.203105D+01
      3   0.245957D+01  0.756372D+00 -0.526927D+01 -0.881498D-01  0.323907D+01
      4  -0.277432D+01  0.591721D+00 -0.439435D+00  0.323445D+01 -0.220361D+00
      5  -0.992105D+00 -0.388079D+00  0.901820D+00 -0.505850D+00  0.301644D+01
      6   0.234388D+00  0.615650D+00 -0.553382D-01  0.168874D+01 -0.398664D+00
               186           187           188           189           190 
      1  -0.439387D-01  0.247682D+01  0.206783D+01 -0.177032D+02 -0.429622D+01
      2   0.755089D+00 -0.648051D+01  0.173029D+01 -0.198513D+02  0.591090D+01
      3  -0.711150D+00  0.400368D+01 -0.379812D+01  0.375545D+02 -0.161468D+01
      4   0.338063D+01  0.142881D+01  0.454826D+01 -0.369681D+01 -0.482570D+01
      5  -0.647921D+00  0.875905D+01 -0.247818D+01  0.241481D+02  0.306488D+01
      6   0.560255D+01  0.263928D+00  0.354500D+01  0.857426D+00  0.235103D+00
               191           192           193           194           195 
      1   0.683179D+01 -0.185438D+01  0.701667D+01 -0.209458D+02  0.473297D+01
      2  -0.870065D+01  0.119139D+01 -0.672498D+01  0.323234D+02 -0.398523D+01
      3   0.186885D+01  0.662993D+00 -0.291695D+00 -0.113776D+02 -0.747736D+00
      4   0.761851D+00  0.178686D+01  0.616044D+01  0.210257D+01 -0.648381D+00
      5  -0.490350D+00 -0.673110D+00 -0.292050D+01  0.190714D+01  0.108762D+01
      6   0.654766D+01 -0.315912D+01  0.140645D+01 -0.122830D+02  0.662880D+01
               196           197           198           199           200 
      1   0.162271D+01  0.747068D+00 -0.452104D+01 -0.586346D+00  0.146293D+01
      2  -0.135112D+01  0.299715D+01  0.247559D+01 -0.255849D+01 -0.105157D+01
      3  -0.271598D+00 -0.374422D+01  0.204545D+01  0.314483D+01 -0.411355D+00
      4   0.322193D+01  0.358653D+01 -0.164703D+01  0.425887D+00 -0.528341D+00
      5  -0.890042D+00 -0.114436D+00  0.593820D+00 -0.186700D+01 -0.276373D-01
      6  -0.213429D+01  0.285957D+01 -0.196821D+01 -0.643528D+00  0.208955D+01
               201           202           203           204           205 
      1  -0.340086D+01 -0.121118D+01 -0.393158D+01  0.220049D+00 -0.322457D+01
      2   0.928651D+00  0.110543D+01  0.149725D+01 -0.454073D+01  0.295572D+01
      3   0.247221D+01  0.105750D+00  0.243433D+01  0.432068D+01  0.268846D+00
      4  -0.108913D+01 -0.179841D+01 -0.312956D+01 -0.527692D-01 -0.412117D+01
      5   0.411045D+01  0.849636D+00  0.346003D+00 -0.218307D+01  0.417312D+01
      6  -0.176180D+01  0.174535D+01 -0.825035D+00  0.243523D+01  0.956448D+00
               206           207           208           209           210 
      1   0.498002D+01 -0.215180D+02 -0.444808D+01 -0.743710D+01 -0.218633D+01
      2  -0.136976D+00 -0.149609D+02  0.615635D+01  0.974234D+01  0.150021D+01
      3  -0.484304D+01  0.364789D+02 -0.170827D+01 -0.230524D+01  0.686127D+00
      4  -0.298410D+01 -0.459852D+00  0.563236D+01  0.121097D+01 -0.166170D+01
      5   0.335387D+01 -0.149873D+02  0.322772D+01  0.742343D+00 -0.568019D+00
      6   0.784583D+01 -0.192672D+02 -0.170207D-01  0.702376D+01  0.346276D+01
               211           212           213           214           215 
      1  -0.716858D+01 -0.204030D+02 -0.464927D+01  0.132988D+01 -0.461008D+00
      2   0.731118D+01  0.317188D+02  0.392538D+01 -0.121892D+01 -0.330425D+01
      3  -0.142603D+00 -0.113158D+02  0.723895D+00 -0.110966D+00  0.376526D+01
      4   0.650575D+01 -0.104422D+00 -0.190404D+00 -0.319585D+01  0.361587D+01
      5   0.294320D+01  0.228655D+01 -0.772939D+00 -0.792926D+00  0.267203D+00
      6   0.180310D+01  0.117513D+02  0.649424D+01  0.228935D+01  0.274076D+01
               216           217           218           219           220 
      1  -0.435410D+01 -0.658364D+00 -0.164352D+01 -0.331475D+01  0.911931D+00
      2   0.232164D+01 -0.249920D+01  0.126208D+01  0.102018D+01 -0.770235D+00
      3   0.203246D+01  0.315757D+01  0.381445D+00  0.229458D+01 -0.141696D+00
      4   0.194523D+01 -0.603324D+00 -0.241913D+00  0.128724D+01 -0.171133D+01
      5   0.680307D+00 -0.185570D+01  0.222982D+00  0.426978D+01 -0.663790D+00
      6   0.191545D+01  0.903009D+00  0.208811D+01  0.169284D+01  0.177299D+01
               221           222           223           224           225 
      1  -0.363131D+01 -0.979465D-01 -0.309045D+01 -0.513551D+01 -0.214785D+02
      2   0.121078D+01  0.447745D+01  0.259127D+01  0.270277D+00 -0.149688D+02
      3   0.242053D+01 -0.437951D+01  0.499178D+00  0.486523D+01  0.364473D+02
      4   0.343742D+01  0.102570D+00  0.425690D+01 -0.294050D+01  0.729612D+00
      5   0.402687D+00  0.207705D+01  0.397851D+01 -0.319870D+01 -0.140974D+02
      6   0.660706D+00  0.229019D+01 -0.782053D+00  0.806030D+01  0.199514D+02
               226           227           228           229           230 
      1   0.147914D+02  0.689866D+01  0.821884D+00  0.123655D+02  0.525050D+01
      2  -0.623018D+01 -0.307538D+01 -0.122903D+01 -0.706568D+01 -0.299749D+00
      3  -0.856123D+01 -0.382328D+01  0.407144D+00 -0.529980D+01 -0.495075D+01
      4   0.112763D+02  0.115285D+02  0.248506D+01  0.897449D+01  0.170632D+02
      5   0.430356D+01  0.313749D+01  0.360520D+01  0.874845D+01  0.295477D+01
      6   0.333166D+01  0.380839D+01  0.130009D+01  0.427177D+01  0.637538D+01
               231           232           233           234           235 
      1   0.267675D+01 -0.599471D+01 -0.105796D+01 -0.703889D+00 -0.311026D+01
      2  -0.405208D+01  0.275421D+01 -0.737847D+00 -0.116072D+01  0.681922D+00
      3   0.137533D+01  0.324050D+01  0.179580D+01  0.186461D+01  0.242834D+01
      4   0.164935D+01  0.225977D+01 -0.234593D+01  0.386150D+01  0.310395D+01
      5   0.574622D+01  0.534206D+00  0.312440D+01  0.909906D+00 -0.954469D+00
      6   0.187520D+01  0.125180D+01  0.774371D+00  0.169448D+01 -0.939864D-01
               236           237           238           239           240 
      1   0.322364D+00  0.362692D+01  0.147472D+00 -0.120750D+01  0.175601D+00
      2   0.400287D+00  0.161436D+01 -0.269867D+00 -0.205698D+01 -0.111489D+01
      3  -0.722651D+00 -0.524127D+01  0.122394D+00  0.326448D+01  0.939289D+00
      4   0.481374D+00  0.499413D+00  0.310798D+01  0.219743D-01  0.331311D+01
      5   0.582895D+00  0.938342D+00  0.745938D+00  0.297644D+01  0.844929D+00
      6   0.614987D+00  0.254862D+00  0.167887D+01  0.170163D+00  0.556045D+01
               241           242           243           244           245 
      1   0.225807D+01 -0.177194D+01 -0.173817D+02 -0.189968D+01 -0.133997D+01
      2  -0.642100D+01 -0.184758D+01 -0.201574D+02 -0.443855D-01  0.277549D+01
      3   0.416293D+01  0.361953D+01  0.375391D+02  0.194407D+01 -0.143552D+01
      4  -0.161354D+01  0.461936D+01  0.358049D+01  0.669624D+01 -0.307942D+01
      5   0.883851D+01  0.224525D+01  0.240579D+02 -0.516810D+01  0.228098D+01
      6  -0.492600D+00  0.345747D+01 -0.189354D+01  0.135953D+02  0.164251D+01
               246           247           248           249           250 
      1  -0.511329D+01 -0.702639D+01  0.197219D+02  0.171963D+02 -0.757508D+01
      2   0.180061D+01  0.127967D+02 -0.264467D+02 -0.319698D+02  0.524406D+01
      3   0.331268D+01 -0.577030D+01  0.672478D+01  0.147736D+02  0.233102D+01
      4   0.134726D+02 -0.358092D+01  0.106474D+02  0.324904D+01  0.152731D+02
      5  -0.305682D+01  0.186575D+01  0.597573D+01  0.199588D+00 -0.418114D+01
      6   0.854594D+01  0.245830D+01 -0.318633D+02 -0.106049D+02  0.116516D+02
               251           252           253           254           255 
      1   0.225795D+02  0.414133D+01 -0.690343D+01  0.338627D+01  0.990230D+01
      2  -0.360638D+02 -0.868273D+01  0.985946D+01 -0.341904D+01 -0.215255D+01
      3   0.134843D+02  0.454139D+01 -0.295603D+01  0.327721D-01 -0.774975D+01
      4   0.607330D+01  0.116877D+02  0.781593D+01  0.137727D+01 -0.657855D+01
      5   0.322283D+01 -0.332518D+00  0.939128D+01  0.303260D+00 -0.291683D+01
      6  -0.143379D+02 -0.198598D+01 -0.649566D+01 -0.381500D+01 -0.461857D+01
               256           257           258           259           260 
      1   0.621781D+01 -0.191800D+02 -0.965195D+01  0.635824D+01 -0.504024D+01
      2  -0.987834D+01  0.198976D+02  0.174341D+02  0.873536D+00  0.862739D+01
      3   0.366053D+01 -0.717667D+00 -0.778218D+01 -0.723178D+01 -0.358715D+01
      4   0.743547D+00 -0.358474D+01 -0.210835D+01 -0.684851D+01 -0.183952D+01
      5   0.664134D+00 -0.700141D+01 -0.158037D+01 -0.162271D+01 -0.336871D+00
      6  -0.268209D+01  0.137021D+02  0.503324D+01 -0.371246D+01  0.213977D+01
               261           262           263           264           265 
      1   0.308477D+01  0.180328D+02 -0.282917D+01 -0.595995D+01 -0.591881D+00
      2   0.584581D+01 -0.159954D+02  0.598507D+01  0.830218D+01  0.250651D+01
      3  -0.893058D+01 -0.203739D+01 -0.315590D+01 -0.234223D+01 -0.191463D+01
      4  -0.288381D+01  0.157597D+02  0.646274D+01 -0.777883D+01  0.127823D+01
      5  -0.221378D+01 -0.183219D+02 -0.306829D+01  0.114201D+02  0.229555D+01
      6  -0.724926D+01 -0.750903D+01 -0.361887D+01  0.669017D+01 -0.278793D+00
               266           267           268           269           270 
      1   0.416554D+01 -0.546261D+00 -0.330372D+01 -0.570275D+00  0.147339D+01
      2  -0.281246D+01 -0.499111D+00  0.678492D+01  0.166017D+01 -0.746868D+01
      3  -0.135308D+01  0.104537D+01 -0.348120D+01 -0.108989D+01  0.599529D+01
      4   0.407014D+00  0.273163D+00 -0.300605D+01 -0.305057D+00  0.339235D+01
      5  -0.352686D+00 -0.131627D+01  0.829820D+01  0.225981D+00 -0.756029D+01
      6   0.138722D+01 -0.747559D-01  0.352481D+01  0.136139D+01 -0.514027D+01
               271           272           273           274           275 
      1  -0.163931D+00  0.658252D+01 -0.774389D+01  0.191624D+01 -0.196100D+01
      2  -0.458870D+01 -0.650520D+01 -0.202269D+01 -0.196577D+01 -0.637765D+00
      3   0.475263D+01 -0.773253D-01  0.976657D+01  0.495244D-01  0.259877D+01
      4  -0.369199D+01 -0.770313D+00 -0.354850D+01 -0.361649D-01 -0.207867D+01
      5   0.188680D+01  0.235520D+00  0.365516D+01  0.121046D-01  0.218224D+01
      6  -0.254147D+01  0.572963D+01 -0.894734D+01  0.243397D+01 -0.261800D+01
               276           277           278           279           280 
      1   0.170238D+01 -0.238363D+01  0.669450D+01 -0.159789D+02  0.122550D+02
      2  -0.748036D+00 -0.121352D+01 -0.235065D+01 -0.129454D+02 -0.250787D+01
      3  -0.954340D+00  0.359715D+01 -0.434385D+01  0.289244D+02 -0.974711D+01
      4   0.130672D+01 -0.338446D+01 -0.950931D+00 -0.321671D+01  0.256287D+02
      5  -0.940408D+00  0.394309D+01  0.370577D+00 -0.141737D+01  0.766930D+01
      6   0.536770D+01 -0.158755D+01  0.805528D+01 -0.211819D+02  0.982172D+01
               281           282           283           284           285 
      1  -0.227668D+01  0.463226D+01 -0.343727D+01 -0.172999D+01 -0.776055D+00
      2   0.101450D+02 -0.122544D+01  0.755025D+01  0.596617D+01  0.867320D+00
      3  -0.786835D+01 -0.340682D+01 -0.411299D+01 -0.423619D+01 -0.912647D-01
      4   0.122412D+02  0.974944D+01  0.649537D+01  0.886215D+01  0.192585D+01
      5   0.175893D+01  0.636781D+01  0.709208D+00  0.178506D+01  0.788945D+00
      6   0.307326D+01  0.867413D+01  0.122331D+01  0.159613D+01  0.355152D+01
               286           287           288           289           290 
      1   0.505747D+01 -0.831455D+00  0.620363D+00 -0.338343D+01 -0.956683D+00
      2  -0.212188D+01  0.417432D+01  0.623515D+00  0.856900D+01  0.603727D+01
      3  -0.293559D+01 -0.334286D+01 -0.124388D+01 -0.518557D+01 -0.508059D+01
      4   0.158227D+02  0.625024D+01  0.106806D+02  0.822955D+01  0.158633D+02
      5   0.795623D+01  0.326858D+01  0.765554D+01 -0.153709D+01 -0.348818D+01
      6   0.110758D+02  0.817346D+01  0.133480D+02 -0.471453D+01 -0.451101D+01
               291           292           293           294           295 
      1   0.106407D+01 -0.511438D+01 -0.379030D+02  0.136029D+02  0.450298D+01
      2  -0.241163D+01  0.118974D+02  0.670724D+02 -0.215672D+02 -0.672720D+01
      3   0.134757D+01 -0.678300D+01 -0.291694D+02  0.796433D+01  0.222421D+01
      4  -0.501518D+01  0.124134D+02  0.203846D+02 -0.779186D+01 -0.584743D+01
      5   0.377633D+01 -0.187462D+01 -0.494892D+01  0.309046D+01  0.410472D+01
      6   0.361863D+01 -0.642902D+01 -0.306757D+02  0.184878D+02  0.772561D+01
               296           297           298           299           300 
      1   0.210504D+02 -0.135521D+02 -0.378271D+01  0.760963D+00  0.867773D+00
      2  -0.305689D+02  0.165112D+02  0.849218D+01 -0.475616D+01 -0.185986D+01
      3   0.951844D+01 -0.295905D+01 -0.470948D+01  0.399519D+01  0.992086D+00
      4  -0.114320D+02  0.846242D+01 -0.648448D+01  0.150870D+02  0.455954D+01
      5   0.542885D+01 -0.450108D+01 -0.111311D+01  0.317209D+01  0.350566D+01
      6   0.276045D+02 -0.214948D+02  0.433200D+01 -0.347760D+01 -0.295001D+01
               301           302           303           304           305 
      1   0.459665D+01 -0.398203D+02 -0.142699D+02  0.401946D+01 -0.221582D+02
      2  -0.102963D+02  0.694845D+02  0.222872D+02 -0.582064D+01  0.317719D+02
      3   0.569962D+01 -0.296642D+02 -0.801726D+01  0.180118D+01 -0.961368D+01
      4   0.112055D+02 -0.168480D+02 -0.641101D+01  0.491617D+01 -0.932817D+01
      5   0.147676D+01 -0.379258D+01 -0.242371D+01  0.356690D+01 -0.436009D+01
      6  -0.532724D+01  0.312952D+02  0.187479D+02 -0.665649D+01  0.281322D+02
               306           307           308           309           310 
      1  -0.142357D+02  0.102617D+02  0.276513D+01  0.379150D+01  0.342925D+01
      2   0.172011D+02 -0.105360D+01 -0.108542D+02 -0.391412D+00 -0.776136D+01
      3  -0.296542D+01 -0.920812D+01  0.808906D+01 -0.340009D+01  0.433211D+01
      4  -0.709686D+01 -0.253868D+02  0.123974D+02 -0.988577D+01  0.672692D+01
      5  -0.354043D+01  0.711832D+01 -0.186638D+01  0.594395D+01 -0.898219D+00
      6   0.216584D+02 -0.994523D+01  0.352450D+01 -0.878207D+01  0.161602D+01
               311           312           313           314           315 
      1  -0.280508D+01  0.772162D+00  0.369864D+01  0.120808D+01 -0.325645D+00
      2   0.758099D+01 -0.101317D+01 -0.917383D+00 -0.467204D+01  0.156097D+01
      3  -0.477591D+01  0.241009D+00 -0.278126D+01  0.346396D+01 -0.123533D+01
      4  -0.929507D+01  0.228067D+01 -0.158005D+02  0.671379D+01 -0.106376D+02
      5   0.182320D+01 -0.894370D+00  0.732301D+01 -0.323060D+01  0.705717D+01
      6  -0.187875D+01  0.397248D+01 -0.110378D+02  0.880347D+01 -0.136729D+02
               316           317           318           319           320 
      1   0.167104D+02  0.281847D+01 -0.521477D+01  0.139914D+00  0.395557D+01
      2  -0.149075D+02 -0.599629D+01  0.760474D+01 -0.207327D+01 -0.237327D+01
      3  -0.180297D+01  0.317782D+01 -0.238997D+01  0.193335D+01 -0.158231D+01
      4  -0.168730D+02  0.677362D+01  0.839861D+01  0.185663D+01 -0.106708D+01
      5  -0.179204D+02  0.369164D+01  0.111723D+02 -0.152658D+01 -0.480091D+00
      6   0.813684D+01 -0.417795D+01 -0.719862D+01 -0.602387D+00 -0.117392D+01
               321           322           323           324           325 
      1   0.800345D+00 -0.299020D+01  0.667644D+00  0.115332D+01 -0.235865D+00
      2   0.138277D+00  0.642471D+01 -0.191191D+01 -0.715401D+01 -0.451912D+01
      3  -0.938623D+00 -0.343451D+01  0.124427D+01  0.600070D+01  0.475499D+01
      4  -0.104260D+00  0.343097D+01 -0.558148D+00 -0.378594D+01  0.348861D+01
      5   0.815243D+00  0.812963D+01 -0.532990D+00 -0.733746D+01  0.200439D+01
      6   0.189407D+00 -0.383531D+01  0.154952D+01  0.548406D+01  0.282284D+01
               326           327           328           329           330 
      1  -0.669589D+01 -0.748521D+01 -0.197945D+01 -0.138890D+01 -0.124872D+01
      2   0.671373D+01 -0.231942D+01  0.212617D+01 -0.121003D+01  0.729933D+00
      3  -0.178364D-01  0.980463D+01 -0.146720D+00  0.259893D+01  0.518790D+00
      4  -0.246383D+00  0.385300D+01  0.744066D-01  0.213307D+01  0.124281D+01
      5   0.351748D-01  0.409805D+01  0.111409D+00  0.229387D+01  0.995170D+00
      6   0.572156D+01  0.900908D+01  0.242108D+01  0.215807D+01  0.492635D+01
               331           332           333 
      1  -0.238624D+01 -0.664760D+01 -0.156756D+02
      2  -0.141034D+01  0.247044D+01 -0.132243D+02
      3   0.379658D+01  0.417716D+01  0.289000D+02
      4   0.340357D+01 -0.693777D+00  0.334731D+01
      5   0.400308D+01 -0.181799D+00 -0.461291D+00
      6   0.177921D+01  0.798664D+01  0.212137D+02
 Leave Link  716 at Thu Jul  8 21:37:14 2021, MaxMem= 10737418240 cpu:               1.7 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) frequency  1    0.085645:
                 1             2             3 
      1   0.157335D+03 -0.354420D-02 -0.259076D-01
      2  -0.354420D-02  0.156142D+03 -0.674529D-03
      3  -0.259076D-01 -0.674529D-03  0.126187D+03
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.085645:
                 1             2             3 
      1  -0.307068D+01  0.122557D+00  0.210596D+01
      2   0.718464D-01  0.181442D+01 -0.394987D-01
      3   0.270821D+01 -0.102079D+00 -0.284749D+01
 Property number 4 -- D-Q polarizability frequency  1    0.085645:
                 1             2             3 
      1  -0.667495D+01 -0.103257D+03 -0.231711D+00
      2   0.681121D+01  0.109894D+03  0.212668D+00
      3  -0.136254D+00 -0.663702D+01  0.190430D-01
      4  -0.100433D+03  0.685889D+01 -0.520817D+01
      5  -0.201957D+00  0.139852D+01 -0.239880D+00
      6  -0.102715D+02  0.181801D+00 -0.100262D+02
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=   111 ND12= 1 LenFil=    3999:
 Frequencies=    0.085645
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1   0.888347D+01  0.104538D+01  0.438423D+01 -0.884547D+00 -0.295936D+01
      2   0.104538D+01 -0.263258D+01  0.945579D-01 -0.295936D+01  0.702687D+00
      3   0.438423D+01  0.945579D-01  0.577987D+00 -0.648214D+00  0.230731D+01
                 6             7             8             9            10 
      1  -0.648214D+00  0.317129D+01 -0.370550D+00  0.689624D+00 -0.104848D+01
      2   0.230731D+01 -0.370550D+00  0.160519D+01  0.127922D+01  0.111143D+01
      3   0.104187D+01  0.689624D+00  0.127922D+01 -0.526016D+00 -0.265325D+01
                11            12            13            14            15 
      1   0.111143D+01 -0.265325D+01  0.255447D+01  0.591839D+01 -0.106102D+01
      2   0.445208D+01 -0.260774D+00  0.591839D+01  0.304234D+01 -0.379239D+01
      3  -0.260774D+00  0.930320D+00 -0.106102D+01 -0.379239D+01 -0.237409D+00
                16            17            18            19            20 
      1  -0.171912D+01 -0.394662D+00  0.126514D+01 -0.278030D+01 -0.416453D+01
      2  -0.394662D+00 -0.284902D+01 -0.223271D+00 -0.416453D+01 -0.658637D+01
      3   0.126514D+01 -0.223271D+00  0.607340D+00  0.346071D+01  0.261656D+01
                21            22            23            24            25 
      1   0.346071D+01 -0.195975D+01 -0.439296D+01  0.138689D+01  0.196454D+01
      2   0.261656D+01 -0.439296D+01 -0.272912D+01  0.278444D+01  0.131074D+01
      3  -0.139492D+01  0.138689D+01  0.278444D+01 -0.159787D+01 -0.117612D+01
                26            27            28            29            30 
      1   0.131074D+01 -0.117612D+01  0.116202D+00  0.205626D+01  0.183799D-02
      2   0.305679D+01 -0.185894D+01  0.205626D+01 -0.160266D+00 -0.168694D+01
      3  -0.185894D+01 -0.189127D+01  0.183799D-02 -0.168694D+01  0.308020D-02
                31            32            33            34            35 
      1   0.192979D+01 -0.143402D+00  0.197756D+01 -0.550450D-02 -0.651887D-01
      2  -0.143402D+00 -0.241352D+01 -0.207093D-02 -0.651887D-01  0.237591D-02
      3   0.197756D+01 -0.207093D-02  0.270907D+00  0.323649D-02  0.132091D+00
                36            37            38            39            40 
      1   0.323649D-02  0.235242D+01 -0.378348D+01 -0.327844D+01 -0.167541D+01
      2   0.132091D+00 -0.378348D+01  0.680207D+01  0.263349D+01  0.450955D+01
      3  -0.287421D-02 -0.327844D+01  0.263349D+01  0.132526D+01  0.140141D+01
                41            42            43            44            45 
      1   0.450955D+01  0.140141D+01 -0.185841D+01  0.125333D+01  0.109133D+01
      2  -0.341592D+01 -0.296407D+01  0.125333D+01 -0.317584D+01 -0.189691D+01
      3  -0.296407D+01 -0.164743D+01  0.109133D+01 -0.189691D+01  0.189449D+01
                46            47            48            49            50 
      1   0.123713D+01  0.614379D+00  0.259529D+01  0.199057D+01 -0.590295D+01
      2   0.614379D+00 -0.437565D+01 -0.205832D+00 -0.590295D+01  0.375499D+01
      3   0.259529D+01 -0.205832D+00 -0.943341D+00 -0.100370D+01  0.384504D+01
                51            52            53            54            55 
      1  -0.100370D+01  0.168435D+01 -0.337903D+00 -0.127304D+01 -0.879366D+01
      2   0.384504D+01 -0.337903D+00  0.287896D+01 -0.178532D+00  0.165986D+01
      3  -0.204955D+00 -0.127304D+01 -0.178532D+00 -0.604889D+00 -0.439803D+01
                56            57            58            59            60 
      1   0.165986D+01 -0.439803D+01 -0.259974D+00  0.294805D+01 -0.561796D+00
      2   0.253360D+01  0.182783D+00  0.294805D+01  0.330985D+00 -0.228572D+01
      3   0.182783D+00 -0.525570D+00 -0.561796D+00 -0.228572D+01  0.106683D+01
                61            62            63            64            65 
      1  -0.318950D+01 -0.303586D+00 -0.626738D+00  0.100096D+02 -0.164076D+01
      2  -0.303586D+00 -0.157652D+01  0.131048D+01 -0.164076D+01 -0.143256D+01
      3  -0.626738D+00  0.131048D+01  0.522890D+00  0.501589D+01 -0.612592D+00
                66            67            68            69            70 
      1   0.501589D+01 -0.470609D+01 -0.558585D+00 -0.193528D+01  0.404066D+01
      2  -0.612592D+00 -0.558585D+00 -0.687051D+00  0.166251D+01  0.145261D-01
      3   0.232812D+01 -0.193528D+01  0.166251D+01 -0.701939D+00  0.229715D+01
                71            72            73            74            75 
      1   0.145261D-01  0.229715D+01 -0.103067D+02 -0.111611D+01 -0.511510D+01
      2   0.112934D+01 -0.281797D+00 -0.111611D+01  0.152246D+01 -0.465177D+00
      3  -0.281797D+00 -0.186271D+01 -0.511510D+01 -0.465177D+00 -0.235260D+01
                76            77            78            79            80 
      1  -0.421542D+01  0.778793D+00 -0.179139D+01 -0.403028D+01  0.138436D+00
      2   0.778793D+00 -0.798579D+00 -0.156069D+01  0.138436D+00 -0.113513D+01
      3  -0.179139D+01 -0.156069D+01 -0.600618D+00 -0.230603D+01 -0.183488D+00
                81            82            83            84            85 
      1  -0.230603D+01 -0.612704D+00  0.174638D+01  0.974525D+00  0.263158D+01
      2  -0.183488D+00  0.174638D+01  0.183919D+01 -0.125917D+01  0.451523D+01
      3   0.186569D+01  0.974525D+00 -0.125917D+01  0.135998D+01 -0.199610D+01
                86            87            88            89            90 
      1   0.451523D+01 -0.199610D+01  0.302809D+00 -0.116293D+01  0.219376D+01
      2   0.891407D+01 -0.525611D+01 -0.116293D+01 -0.313371D+01  0.102139D+01
      3  -0.525611D+01  0.124702D+01  0.219376D+01  0.102139D+01  0.844301D+00
                91            92            93            94            95 
      1  -0.130087D+01 -0.495922D+00 -0.245798D+01 -0.775243D+00 -0.230730D+01
      2  -0.495922D+00 -0.338630D+00  0.578109D+00 -0.230730D+01 -0.484473D+01
      3  -0.245798D+01  0.578109D+00 -0.160962D+01  0.627388D+00  0.488983D+01
                96            97            98            99           100 
      1   0.627388D+00 -0.300794D+01  0.125852D+01 -0.218193D+01  0.115123D+02
      2   0.488983D+01  0.125852D+01  0.650712D+01 -0.200965D+01 -0.232407D+01
      3  -0.959504D+00 -0.218193D+01 -0.200965D+01  0.213487D+00  0.343687D+01
               101           102           103           104           105 
      1  -0.232407D+01  0.343687D+01  0.212029D+00  0.101953D+01  0.329793D+00
      2   0.141679D+01 -0.596729D+00  0.101953D+01 -0.854837D+00  0.691250D+00
      3  -0.596729D+00  0.220283D+01  0.329793D+00  0.691250D+00 -0.212991D+00
               106           107           108           109           110 
      1   0.324992D+01 -0.643971D+00  0.257731D+01 -0.380726D+00 -0.835237D+00
      2  -0.643971D+00  0.635157D+00 -0.797532D+00 -0.835237D+00 -0.145870D+01
      3   0.257731D+01 -0.797532D+00  0.166795D+01  0.102484D+01  0.552926D+00
               111           112           113           114           115 
      1   0.102484D+01 -0.102889D+01 -0.182791D+00  0.103606D+00  0.123398D+01
      2   0.552926D+00 -0.182791D+00 -0.450910D+01  0.218255D+01 -0.230519D+00
      3  -0.862233D+00  0.103606D+00  0.218255D+01 -0.220983D+01  0.548114D-01
               116           117           118           119           120 
      1  -0.230519D+00  0.548114D-01  0.375246D+01 -0.262745D+01 -0.125623D+01
      2   0.197127D+01 -0.179634D+01 -0.262745D+01  0.274770D+01  0.649113D+00
      3  -0.179634D+01  0.227585D+01 -0.125623D+01  0.649113D+00  0.110596D+01
               121           122           123           124           125 
      1  -0.421823D+01  0.488878D+01  0.153256D+01 -0.156345D+01  0.130803D+01
      2   0.488878D+01 -0.728752D+01 -0.257877D+01  0.130803D+01 -0.202733D+01
      3   0.153256D+01 -0.257877D+01 -0.172947D+01  0.174818D+01 -0.180491D+01
               126           127           128           129           130 
      1   0.174818D+01  0.322586D+01  0.949653D+00 -0.169983D+01  0.216634D+01
      2  -0.180491D+01  0.949653D+00  0.115410D+01 -0.445286D+00  0.150378D+01
      3  -0.143646D+01 -0.169983D+01 -0.445286D+00  0.157698D+01 -0.848394D+00
               131           132           133           134           135 
      1   0.150378D+01 -0.848394D+00 -0.204467D+01 -0.160952D+00  0.159255D+01
      2   0.194888D+01 -0.144964D+01 -0.160952D+00 -0.118562D+01  0.749135D+00
      3  -0.144964D+01  0.169588D+01  0.159255D+01  0.749135D+00 -0.217219D+01
               136           137           138           139           140 
      1  -0.417907D+01 -0.278837D+01  0.135488D+01 -0.447259D+01 -0.488643D+01
      2  -0.278837D+01 -0.281569D+01  0.703500D+00 -0.488643D+01 -0.673626D+01
      3   0.135488D+01  0.703500D+00 -0.118060D+01  0.158793D+01  0.248292D+01
               141           142           143           144           145 
      1   0.158793D+01  0.168255D+01  0.132660D+01 -0.182767D+01 -0.305812D+01
      2   0.248292D+01  0.132660D+01  0.191573D+01 -0.173002D+01  0.970618D+00
      3  -0.168191D+01 -0.182767D+01 -0.173002D+01  0.143953D+01  0.164283D+01
               146           147           148           149           150 
      1   0.970618D+00  0.164283D+01  0.217531D+01 -0.155461D+01 -0.856810D+00
      2  -0.115381D+01 -0.453269D+00 -0.155461D+01  0.213508D+01  0.150636D+01
      3  -0.453269D+00 -0.150133D+01 -0.856810D+00  0.150636D+01  0.176052D+01
               151           152           153           154           155 
      1   0.202991D+01 -0.196208D+00 -0.155664D+01 -0.116745D+02 -0.192921D+01
      2  -0.196208D+00  0.120066D+01  0.815544D+00 -0.192921D+01 -0.126774D+01
      3  -0.155664D+01  0.815544D+00  0.216485D+01 -0.344599D+01 -0.479864D+00
               156           157           158           159           160 
      1  -0.344599D+01  0.621692D+00 -0.980610D+00  0.447114D+00 -0.330905D+01
      2  -0.479864D+00 -0.980610D+00 -0.713739D+00 -0.685861D+00 -0.531918D+00
      3  -0.221234D+01  0.447114D+00 -0.685861D+00 -0.118641D+00 -0.261383D+01
               161           162           163           164           165 
      1  -0.531918D+00 -0.261383D+01  0.270885D+00 -0.785730D+00 -0.999031D+00
      2  -0.586188D+00 -0.687383D+00 -0.785730D+00  0.133544D+01  0.501947D+00
      3  -0.687383D+00 -0.167130D+01 -0.999031D+00  0.501947D+00  0.765204D+00
               166           167           168           169           170 
      1  -0.104243D+01  0.664503D-01  0.524136D-01 -0.125863D+01 -0.261362D+00
      2   0.664503D-01 -0.458795D+01 -0.220818D+01 -0.261362D+00 -0.194906D+01
      3   0.524136D-01 -0.220818D+01 -0.224380D+01 -0.132811D+00 -0.179088D+01
               171           172           173           174           175 
      1  -0.132811D+00 -0.250612D+01  0.176579D+01  0.608363D-01  0.380911D+01
      2  -0.179088D+01  0.176579D+01 -0.238919D+01  0.401923D+00 -0.142029D+01
      3  -0.227143D+01  0.608363D-01  0.401923D+00 -0.459229D+00  0.149564D+01
               176           177           178           179           180 
      1  -0.142029D+01  0.149564D+01  0.179803D+01  0.477670D+00  0.286409D+00
      2   0.353779D+01 -0.197613D+00  0.477670D+00  0.149714D+00  0.701552D+00
      3  -0.197613D+00  0.125773D+01  0.286409D+00  0.701552D+00 -0.214747D+00
               181           182           183           184           185 
      1   0.147829D+01  0.379824D+00  0.238795D+00 -0.100450D+00 -0.686709D+00
      2   0.379824D+00 -0.602863D+00  0.396960D-01 -0.686709D+00  0.112113D+00
      3   0.238795D+00  0.396960D-01  0.812403D+00  0.305405D-01 -0.806216D+00
               186           187           188           189           190 
      1   0.305405D-01 -0.203592D+01 -0.245423D+00 -0.146595D+01  0.156257D+01
      2  -0.806216D+00 -0.245423D+00 -0.110662D+01  0.701275D+00  0.155249D-01
      3   0.132626D+00 -0.146595D+01  0.701275D+00 -0.750002D+01 -0.672398D+00
               191           192           193           194           195 
      1   0.155249D-01 -0.672398D+00 -0.191303D+01  0.827778D+00 -0.307877D-01
      2   0.227708D+01 -0.110020D+01  0.827778D+00 -0.626791D+01  0.100323D+01
      3  -0.110020D+01  0.760370D+00 -0.307877D-01  0.100323D+01 -0.112713D+01
               196           197           198           199           200 
      1  -0.986577D+00 -0.963514D+00  0.687145D+00 -0.390031D+00  0.242475D+00
      2  -0.963514D+00 -0.827098D+00 -0.200490D+00  0.242475D+00  0.731343D+00
      3   0.687145D+00 -0.200490D+00  0.308128D+00  0.469749D+00 -0.391034D+00
               201           202           203           204           205 
      1   0.469749D+00  0.617971D+00  0.116004D+01 -0.488010D+00  0.153676D+01
      2  -0.391034D+00  0.116004D+01  0.193627D+00  0.109442D+00  0.546039D+00
      3   0.317253D+00 -0.488010D+00  0.109442D+00  0.674452D+00 -0.344555D+00
               206           207           208           209           210 
      1   0.546039D+00 -0.344555D+00 -0.165953D+01 -0.634624D-01  0.619112D+00
      2   0.150010D+01 -0.149347D+01 -0.634624D-01 -0.254684D+01 -0.116738D+01
      3  -0.149347D+01  0.735553D+01  0.619112D+00 -0.116738D+01 -0.807366D+00
               211           212           213           214           215 
      1  -0.192519D+01 -0.101705D+01 -0.101744D+00  0.905652D+00 -0.964134D+00
      2  -0.101705D+01 -0.607870D+01 -0.940189D+00 -0.964134D+00  0.922497D+00
      3  -0.101744D+00 -0.940189D+00 -0.108937D+01 -0.695006D+00 -0.168857D+00
               216           217           218           219           220 
      1  -0.695006D+00  0.430146D+00  0.140052D+00 -0.507547D+00  0.493557D+00
      2  -0.168857D+00  0.140052D+00 -0.737136D+00 -0.373743D+00 -0.117980D+01
      3  -0.302816D+00 -0.507547D+00 -0.373743D+00 -0.290530D+00 -0.468292D+00
               221           222           223           224           225 
      1  -0.117980D+01 -0.468292D+00 -0.148893D+01  0.547256D+00  0.275402D+00
      2   0.322667D+00 -0.738110D-01  0.547256D+00 -0.155124D+01 -0.151708D+01
      3  -0.738110D-01  0.676727D+00  0.275402D+00 -0.151708D+01 -0.735324D+01
               226           227           228           229           230 
      1   0.281460D+01  0.181230D+01  0.174354D-01  0.380533D+01  0.132510D+01
      2   0.181230D+01  0.238443D+01  0.409016D+00  0.132510D+01  0.331759D+01
      3   0.174354D-01  0.409016D+00  0.509971D+00  0.150007D+01  0.115445D+00
               231           232           233           234           235 
      1   0.150007D+01 -0.175284D+01  0.547145D+00 -0.256501D+00 -0.143998D+01
      2   0.115445D+00  0.547145D+00 -0.192846D+00  0.712923D+00  0.496939D+00
      3   0.123595D+01 -0.256501D+00  0.712923D+00  0.214811D+00 -0.233387D+00
               236           237           238           239           240 
      1   0.496939D+00 -0.233387D+00  0.199782D-01  0.672160D+00  0.743340D-01
      2   0.569472D+00  0.837922D-01  0.672160D+00  0.278476D-01  0.800499D+00
      3   0.837922D-01 -0.806539D+00  0.743340D-01  0.800499D+00  0.167299D+00
               241           242           243           244           245 
      1   0.201161D+01 -0.284943D+00  0.149434D+01  0.123125D+01 -0.443818D+00
      2  -0.284943D+00  0.112903D+01  0.636937D+00 -0.443818D+00  0.161757D+00
      3   0.149434D+01  0.636937D+00  0.749611D+01  0.249832D+01  0.249935D+00
               246           247           248           249           250 
      1   0.249832D+01 -0.634341D+00  0.214002D+01  0.301051D+00  0.310061D+01
      2   0.249935D+00  0.214002D+01 -0.506140D+01 -0.492961D+01  0.832753D+00
      3   0.156470D+01  0.301051D+00 -0.492961D+01 -0.102872D+01  0.208923D+01
               251           252           253           254           255 
      1   0.832753D+00  0.208923D+01  0.863730D+00  0.143281D+01 -0.111322D+01
      2  -0.660312D+01 -0.210210D+01  0.143281D+01 -0.156467D+01 -0.969850D+00
      3  -0.210210D+01 -0.213449D+00 -0.111322D+01 -0.969850D+00 -0.129981D+01
               256           257           258           259           260 
      1   0.220423D+01 -0.428109D+01 -0.171066D+01 -0.399147D+00 -0.100318D+01
      2  -0.428109D+01  0.937210D+01  0.538187D+01 -0.100318D+01  0.323444D+01
      3  -0.171066D+01  0.538187D+01  0.130117D+01 -0.214488D+01  0.111472D+01
               261           262           263           264           265 
      1  -0.214488D+01  0.560105D+01  0.729860D+00 -0.267342D+01 -0.510622D-01
      2   0.111472D+01  0.729860D+00  0.258378D+01 -0.621572D+00  0.163374D+00
      3  -0.842890D+00 -0.267342D+01 -0.621572D+00  0.209272D+01  0.457533D+00
               266           267           268           269           270 
      1   0.163374D+00  0.457533D+00 -0.170255D+01  0.208241D+00  0.120100D+01
      2  -0.109603D+01  0.669443D+00  0.208241D+00  0.432231D+00  0.775469D-02
      3   0.669443D+00 -0.419111D+00  0.120100D+01  0.775469D-02 -0.185361D+01
               271           272           273           274           275 
      1  -0.486647D+00 -0.592529D+00 -0.740712D+00  0.125058D+00 -0.923621D+00
      2  -0.592529D+00 -0.248664D+01  0.115705D+01 -0.923621D+00 -0.217714D+00
      3  -0.740712D+00  0.115705D+01 -0.214525D+01  0.438385D+00 -0.183515D+00
               276           277           278           279           280 
      1   0.438385D+00 -0.109126D+01 -0.998162D-01 -0.514045D+00  0.426318D+01
      2  -0.183515D+00 -0.998162D-01 -0.167407D+01  0.135348D+01  0.124945D+01
      3   0.488108D+00 -0.514045D+00  0.135348D+01 -0.588763D+01  0.166246D+01
               281           282           283           284           285 
      1   0.124945D+01  0.166246D+01  0.531872D+00  0.126805D+01  0.985529D-01
      2   0.213908D+01  0.427539D+00  0.126805D+01  0.981136D+00  0.298595D+00
      3   0.427539D+00  0.150784D+01  0.985529D-01  0.298595D+00  0.273086D+00
               286           287           288           289           290 
      1   0.270535D+01  0.503283D+00  0.182354D+01  0.103086D+01  0.179092D+01
      2   0.503283D+00  0.872743D+00  0.989933D+00  0.179092D+01  0.130954D+01
      3   0.182354D+01  0.989933D+00  0.220087D+01 -0.417457D+00 -0.582075D+00
               291           292           293           294           295 
      1  -0.417457D+00  0.155833D+01  0.189171D+01 -0.671515D+00 -0.445825D+00
      2  -0.582075D+00  0.189171D+01  0.978715D+01 -0.318131D+01 -0.145389D+01
      3   0.497534D+00 -0.671515D+00 -0.318131D+01  0.204639D+01  0.105180D+01
               296           297           298           299           300 
      1  -0.145389D+01  0.105180D+01 -0.809482D+00  0.170295D+01  0.366958D+00
      2  -0.561061D+01  0.334650D+01  0.170295D+01 -0.102575D+01 -0.456789D+00
      3   0.334650D+01 -0.261814D+01  0.366958D+00 -0.456789D+00 -0.405772D+00
               301           302           303           304           305 
      1   0.144432D+01 -0.159715D+01 -0.546558D+00  0.326990D+00 -0.121950D+01
      2  -0.159715D+01  0.999622D+01  0.323002D+01 -0.121950D+01  0.572817D+01
      3  -0.546558D+00  0.323002D+01  0.206548D+01 -0.902089D+00  0.338866D+01
               306           307           308           309           310 
      1  -0.902089D+00 -0.412791D+01  0.128359D+01 -0.163713D+01  0.605170D+00
      2   0.338866D+01  0.128359D+01 -0.220308D+01  0.488442D+00 -0.130214D+01
      3   0.261607D+01 -0.163713D+01  0.488442D+00 -0.149413D+01  0.157652D+00
               311           312           313           314           315 
      1  -0.130214D+01  0.157652D+00 -0.265741D+01  0.582865D+00 -0.177787D+01
      2   0.119361D+01 -0.324012D+00  0.582865D+00 -0.919552D+00  0.106896D+01
      3  -0.324012D+00  0.339420D+00 -0.177787D+01  0.106896D+01 -0.220086D+01
               316           317           318           319           320 
      1  -0.552779D+01  0.854803D+00  0.266282D+01  0.178627D+00 -0.246891D+00
      2   0.854803D+00 -0.270143D+01 -0.770908D+00 -0.246891D+00 -0.959436D+00
      3   0.266282D+01 -0.770908D+00 -0.211151D+01  0.309334D+00 -0.654940D+00
               321           322           323           324           325 
      1   0.309334D+00  0.172036D+01  0.111492D+00 -0.120164D+01  0.446758D+00
      2  -0.654940D+00  0.111492D+00 -0.444355D+00  0.630194D-01 -0.460581D+00
      3  -0.324695D+00 -0.120164D+01  0.630194D-01  0.185674D+01  0.810759D+00
               326           327           328           329           330 
      1  -0.460581D+00  0.810759D+00  0.187316D+00  0.926966D+00  0.410518D+00
      2   0.251971D+01  0.112879D+01  0.926966D+00 -0.411348D+00  0.113960D+00
      3   0.112879D+01  0.216420D+01  0.410518D+00  0.113960D+00  0.393943D+00
               331           332           333 
      1   0.108169D+01 -0.727554D-01  0.575379D+00
      2  -0.727554D-01  0.167643D+01  0.132807D+01
      3   0.575379D+00  0.132807D+01  0.588193D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.326266D-01  0.216687D+01 -0.298267D+01  0.323998D+01  0.587016D+01
      2   0.226891D+01 -0.116421D+00  0.988102D+01 -0.640883D+00 -0.124726D+02
      3  -0.324675D+01 -0.104507D+02 -0.185909D+01 -0.631506D+01  0.519168D+01
                 6             7             8             9            10 
      1  -0.255734D+01 -0.261620D+00 -0.732478D+00 -0.785746D+00 -0.416581D+01
      2  -0.355031D+01  0.251980D+01  0.735593D+00  0.337309D+00  0.102986D+02
      3   0.946811D+01 -0.141978D+01  0.103074D+02  0.349060D+01  0.436035D+01
                11            12            13            14            15 
      1   0.476827D+01  0.518888D-01  0.463242D+01 -0.115156D+01 -0.780501D+01
      2  -0.377624D+01  0.429695D+01 -0.521012D+01  0.176204D+00  0.621811D+01
      3   0.651203D+01  0.751581D+01  0.999827D+01 -0.594850D+01 -0.643500D+01
                16            17            18            19            20 
      1  -0.128923D+01 -0.146575D+01 -0.326808D+00  0.128064D+00 -0.133459D+01
      2   0.160452D+01  0.786595D+00 -0.344689D+00 -0.135404D+02 -0.657483D+01
      3   0.816857D+01 -0.676362D+01 -0.333873D+01 -0.154870D+02 -0.126792D+02
                21            22            23            24            25 
      1   0.633159D+01  0.712492D+01  0.211452D+02 -0.520390D+01  0.125061D+02
      2   0.102129D+00 -0.331661D+01  0.463976D+01 -0.564610D+01 -0.117516D+02
      3   0.411624D+01  0.619140D+01  0.224580D+02 -0.749578D+01  0.304324D+01
                26            27            28            29            30 
      1   0.167767D+02 -0.209208D+02 -0.185185D+00 -0.365405D+01  0.316515D-01
      2  -0.107930D+02  0.120877D+02 -0.344876D+01  0.263510D+00  0.183136D+00
      3  -0.164388D+01  0.571545D+00 -0.932169D-03 -0.141011D+01 -0.389579D-01
                31            32            33            34            35 
      1  -0.173302D+01  0.195079D+00  0.323893D+00 -0.889742D-01 -0.305617D+00
      2   0.658731D-01  0.124639D+01 -0.296703D-03  0.767601D+00  0.129284D+00
      3  -0.354211D+00 -0.115509D-01  0.142427D+01  0.518859D-01  0.746821D+00
                36            37            38            39            40 
      1   0.857185D-01 -0.485564D+00 -0.197916D+01 -0.648667D+01  0.638241D+01
      2  -0.431495D+00 -0.130363D+02  0.739400D+01  0.624551D+00  0.384606D+01
      3  -0.243047D-01  0.150555D+02 -0.143331D+02 -0.440012D+01  0.452373D+01
                41            42            43            44            45 
      1  -0.211651D+02 -0.465820D+01 -0.121832D+02  0.178273D+02  0.213795D+02
      2   0.507791D+01  0.584704D+01 -0.106933D+02  0.104862D+02  0.111099D+02
      3  -0.220884D+02 -0.729474D+01 -0.310047D+01 -0.142048D+01 -0.576549D+00
                46            47            48            49            50 
      1   0.503101D+01  0.475582D+01 -0.232207D+00  0.467936D+01  0.745234D+00
      2   0.104706D+02  0.312379D+01  0.404215D+01  0.454432D+01 -0.217317D+00
      3  -0.365191D+01  0.688304D+01 -0.779921D+01  0.103891D+02  0.519880D+01
                51            52            53            54            55 
      1  -0.806869D+01  0.128099D+01 -0.156455D+01  0.328222D+00  0.333022D+00
      2  -0.606555D+01  0.149670D+01 -0.794459D+00 -0.343767D+00  0.228485D+01
      3  -0.610257D+01 -0.844883D+01 -0.642479D+01  0.336105D+01  0.257245D+01
                56            57            58            59            60 
      1   0.187003D+01  0.328035D+01  0.298194D+01 -0.664242D+01 -0.254557D+01
      2  -0.601100D+00  0.988331D+01 -0.107799D+00 -0.122060D+02  0.324448D+01
      3  -0.107552D+02  0.227447D+01 -0.661994D+01 -0.442900D+01  0.937438D+01
                61            62            63            64            65 
      1   0.328161D+00 -0.779288D+00  0.783074D+00 -0.667420D+01 -0.100090D+02
      2   0.247059D+01 -0.798906D+00  0.286440D+00  0.183700D+02 -0.203930D+01
      3   0.187485D+01  0.102430D+02 -0.350015D+01  0.104215D+02  0.889848D+01
                66            67            68            69            70 
      1  -0.516267D+01 -0.166391D+02  0.272703D+01 -0.683754D+01 -0.269972D+01
      2   0.268322D+00  0.516192D+01  0.550312D+01  0.501710D+01 -0.254721D+02
      3   0.428055D+01  0.265913D+02 -0.288698D+01  0.725667D+01 -0.319146D+00
                71            72            73            74            75 
      1   0.230735D+01 -0.217596D+00  0.633984D+01 -0.103080D+02  0.491095D+01
      2   0.278125D+01 -0.248481D+02  0.180477D+02  0.197108D+01 -0.162185D+00
      3   0.389412D+01  0.774144D+00 -0.894387D+01  0.944743D+01 -0.400506D+01
                76            77            78            79            80 
      1  -0.172902D+02 -0.136737D+01 -0.727932D+01  0.174947D+01  0.210220D+01
      2  -0.490245D+01  0.575988D+01 -0.472071D+01 -0.256509D+02 -0.182514D+01
      3   0.271680D+02  0.138965D+01  0.745418D+01  0.384427D+00  0.389019D+01
                81            82            83            84            85 
      1  -0.844493D+00 -0.493938D+01  0.318729D+01  0.179198D+01  0.146247D+01
      2  -0.248534D+02 -0.140950D+02 -0.133621D+02  0.133458D+02 -0.467630D+01
      3  -0.789030D+00 -0.193849D+02 -0.216567D+02  0.141947D+02 -0.294351D+01
                86            87            88            89            90 
      1   0.142059D+02  0.379085D+01  0.790165D+01  0.224620D+02 -0.141075D+02
      2  -0.837468D-01 -0.398983D+01 -0.250192D+01 -0.132143D+02  0.113156D+02
      3   0.108730D+02  0.260353D+00  0.749216D+01 -0.151346D+01  0.281349D+01
                91            92            93            94            95 
      1   0.826738D+01  0.326953D+01  0.727143D+01  0.456570D+01 -0.955378D+01
      2  -0.206202D+01  0.101307D+01 -0.302946D+00 -0.949008D-02  0.265913D+01
      3  -0.727209D+01 -0.134502D+01 -0.636905D+01  0.488507D+01  0.870054D+00
                96            97            98            99           100 
      1  -0.528318D+01  0.559583D+01 -0.298856D+01  0.165076D+01  0.897948D+00
      2  -0.484238D+00 -0.363298D+01  0.393368D+00 -0.444995D+00 -0.365796D+01
      3  -0.723196D+01 -0.113276D+02 -0.765429D+01 -0.618624D+01 -0.824289D+01
               101           102           103           104           105 
      1   0.204413D+01  0.292369D+01 -0.351396D+00  0.114179D+01 -0.111450D+01
      2   0.176229D+01  0.472251D+01 -0.219761D+01  0.196241D+01 -0.167125D+01
      3  -0.402307D+01 -0.349497D+01 -0.623282D+00 -0.396650D+00 -0.178253D+01
               106           107           108           109           110 
      1   0.211020D+01  0.104751D+01  0.142393D+01  0.142884D+01 -0.145324D+01
      2   0.208757D+01 -0.489949D+00  0.249691D+01  0.502325D+01  0.241752D+01
      3  -0.141877D+01 -0.282698D+01 -0.101231D+01  0.542578D+01  0.572279D+01
               111           112           113           114           115 
      1  -0.191652D+01 -0.340840D+00 -0.145273D+01 -0.309083D+01 -0.303926D+00
      2  -0.368480D+01  0.152666D+01  0.679228D+01 -0.649653D+01 -0.327575D+01
      3  -0.367115D+01  0.500257D+01  0.131407D+02 -0.668587D+01 -0.182751D+01
               116           117           118           119           120 
      1   0.178073D+00  0.223539D+01 -0.772641D+00 -0.264800D+00  0.217323D+01
      2  -0.499740D+01  0.615870D+01 -0.101681D+01  0.660491D+00  0.371619D+01
      3  -0.555300D+01  0.585095D+01  0.257092D+00 -0.377919D+01  0.394264D-01
               121           122           123           124           125 
      1  -0.288541D+01  0.298331D+01 -0.236963D+01  0.125944D+01 -0.464396D+00
      2  -0.329698D+01 -0.322761D+00 -0.354521D+01  0.868496D+00 -0.287521D+01
      3  -0.375684D+00  0.908888D+01  0.390893D+01  0.177062D+01  0.251155D+01
               126           127           128           129           130 
      1  -0.145487D+01 -0.441461D+01 -0.180161D+01  0.281058D+01 -0.290741D+01
      2  -0.220854D+01 -0.229776D+01  0.261954D+00  0.381480D+01  0.872428D+00
      3   0.101553D+01 -0.767518D+01 -0.627999D+01  0.445055D+01 -0.682569D+01
               131           132           133           134           135 
      1  -0.590970D+01  0.388907D+01  0.275556D+01  0.445179D+01 -0.432346D+01
      2  -0.344192D+01  0.565645D+01  0.124609D+01  0.257819D+01 -0.490494D+01
      3  -0.113885D+02  0.615862D+01  0.411828D+01  0.438640D+01 -0.583840D+01
               136           137           138           139           140 
      1   0.592168D+00 -0.445931D+00 -0.210397D+01 -0.289808D+01 -0.285659D+01
      2  -0.931134D+00 -0.619968D+00  0.396386D+01  0.345494D+01 -0.314006D+00
      3  -0.450417D+00 -0.415424D+01  0.131093D+00 -0.754210D+00 -0.888585D+01
               141           142           143           144           145 
      1  -0.212392D+01 -0.123159D+01 -0.283091D+00  0.135869D+01  0.410615D+01
      2   0.347833D+01  0.104539D+01  0.285066D+01 -0.227298D+01 -0.252446D+01
      3   0.390944D+01 -0.166007D+01  0.258725D+01 -0.102048D+01  0.712308D+01
               146           147           148           149           150 
      1  -0.176056D+01 -0.247771D+01 -0.287403D+01  0.595917D+01  0.374217D+01
      2  -0.234333D+00  0.368823D+01 -0.795026D+00 -0.364607D+01 -0.597625D+01
      3  -0.613526D+01 -0.417672D+01 -0.665734D+01  0.119654D+02  0.634501D+01
               151           152           153           154           155 
      1  -0.250522D+01  0.444688D+01  0.408939D+01 -0.981605D+00  0.196281D+01
      2   0.124006D+01 -0.282463D+01 -0.507377D+01 -0.357384D+01 -0.160521D+01
      3  -0.391829D+01  0.456940D+01  0.583165D+01  0.801635D+01 -0.434746D+01
               156           157           158           159           160 
      1  -0.276459D+01 -0.264225D+00 -0.112946D+01 -0.924449D+00 -0.196661D+01
      2   0.492114D+01  0.245451D+01  0.198668D+01  0.150909D+01  0.219392D+01
      3   0.341480D+01 -0.944412D+00  0.602231D+00 -0.193276D+01  0.128975D+01
               161           162           163           164           165 
      1   0.115748D+01 -0.131779D+01 -0.128124D+01 -0.142819D+01  0.163278D+01
      2   0.348331D+00  0.256525D+01  0.494340D+01 -0.229069D+01 -0.347948D+01
      3  -0.289185D+01  0.101243D+01 -0.501844D+01  0.539404D+01  0.338766D+01
               166           167           168           169           170 
      1  -0.273231D+00  0.183529D+01 -0.288878D+01  0.179474D+00  0.386137D+00
      2  -0.146469D+01  0.689755D+01  0.678164D+01 -0.307461D+01  0.511825D+01
      3   0.469325D+01 -0.136224D+02 -0.684532D+01  0.159315D+01 -0.562298D+01
               171           172           173           174           175 
      1  -0.196521D+01 -0.226606D+01  0.292860D+01 -0.223525D+00  0.450672D+01
      2   0.623495D+01 -0.183755D+01  0.188332D+01  0.193392D+01  0.543273D+01
      3  -0.584543D+01  0.289572D+01 -0.504699D+01  0.342411D+00 -0.419293D+01
               176           177           178           179           180 
      1  -0.767407D+01  0.244792D+00  0.143930D+01 -0.622653D+00 -0.332411D+00
      2  -0.167878D+01  0.117896D+00  0.378442D+01 -0.110706D+01  0.899893D+00
      3   0.105061D+02 -0.145637D+01 -0.708132D+00  0.216300D+01  0.541346D+00
               181           182           183           184           185 
      1  -0.209788D+01 -0.817054D+00 -0.940341D+00  0.204979D-01 -0.675348D+00
      2   0.267299D+00  0.836823D+00 -0.352900D+01 -0.649455D+00  0.192046D+01
      3   0.166546D+01  0.315784D-01  0.392342D+00  0.659487D+00  0.652775D+00
               186           187           188           189           190 
      1   0.762804D+00  0.103302D+01  0.287448D+01 -0.478372D+00  0.568407D+00
      2  -0.498104D+00  0.261373D+00 -0.243280D+01  0.164022D+02 -0.310502D+01
      3  -0.170525D+01 -0.141721D+01 -0.251466D+01  0.172497D+01 -0.396013D+01
               191           192           193           194           195 
      1   0.486316D+01 -0.952886D+00  0.119204D+01 -0.748596D+01 -0.120803D+01
      2   0.220488D+01  0.117177D+00  0.276952D+01 -0.336787D+01  0.138938D+01
      3   0.499129D+01 -0.170522D+01  0.557010D+01 -0.927280D+01  0.143533D+01
               196           197           198           199           200 
      1  -0.800292D+00 -0.355508D+01  0.167454D+00  0.445475D+00 -0.138815D+01
      2  -0.318256D-01  0.826425D+00 -0.730243D+00 -0.179162D+01  0.423968D+00
      3   0.105569D+01 -0.136730D+01 -0.690677D+00 -0.114366D+01 -0.101570D+01
               201           202           203           204           205 
      1   0.138655D+01 -0.850982D+00 -0.173812D+00  0.305376D+01 -0.276493D+00
      2  -0.116796D+01 -0.923836D+00 -0.140970D+01 -0.614648D+00 -0.313302D+01
      3  -0.124334D+01 -0.365631D+00 -0.113799D+01  0.127346D+01 -0.284975D+01
               206           207           208           209           210 
      1  -0.953004D+00  0.134922D+02 -0.420825D+00  0.511194D+01  0.881126D+00
      2   0.138883D+01 -0.935060D+01 -0.333778D+01 -0.242206D+01  0.363719D-01
      3   0.152968D+00 -0.150654D+01  0.448831D+01  0.518340D+01  0.174836D+01
               211           212           213           214           215 
      1   0.140862D+01  0.705469D+01 -0.131929D+01  0.643575D+00 -0.364511D+01
      2  -0.283474D+01 -0.345250D+01 -0.133701D+01 -0.775260D-01 -0.660233D+00
      3   0.579825D+01  0.880474D+01  0.134944D+01 -0.112321D+01 -0.132539D+01
               216           217           218           219           220 
      1  -0.199324D+00 -0.619092D+00 -0.138278D+01 -0.130817D+01 -0.771486D+00
      2  -0.726284D+00 -0.174497D+01 -0.349884D+00 -0.108609D+01  0.975173D+00
      3   0.686453D+00  0.108834D+01 -0.101156D+01  0.130176D+01 -0.362569D+00
               221           222           223           224           225 
      1   0.210448D+00  0.311018D+01  0.947785D-01 -0.105067D+01 -0.138827D+02
      2  -0.144787D+01  0.517761D+00 -0.318327D+01 -0.122166D+01 -0.874919D+01
      3   0.120149D+01  0.121608D+01  0.285428D+01  0.325650D-01  0.152577D+01
               226           227           228           229           230 
      1   0.245572D+01  0.310029D+01  0.276176D+00  0.448009D+01  0.729151D+01
      2  -0.223069D+01 -0.204215D+01  0.195147D+01 -0.559734D+01 -0.171003D+01
      3  -0.324369D+01 -0.538861D+01 -0.350465D+00 -0.450147D+01 -0.101145D+02
               231           232           233           234           235 
      1   0.218315D+00 -0.130884D+01 -0.502047D+00  0.356385D+00  0.205858D+01
      2  -0.190680D+00  0.389219D+01  0.967750D+00  0.891289D+00  0.173990D+00
      3  -0.142062D+01  0.822720D+00  0.212937D+01 -0.535157D+00 -0.162979D+01
               236           237           238           239           240 
      1  -0.903539D+00  0.824237D+00 -0.119921D-01  0.793514D+00  0.747257D+00
      2  -0.718987D+00 -0.354542D+01  0.731513D+00  0.189727D+01  0.616348D+00
      3   0.752333D-01 -0.467120D+00  0.706712D+00 -0.679666D+00 -0.168650D+01
               241           242           243           244           245 
      1  -0.893138D+00  0.300906D+01  0.118213D+01 -0.797336D+01  0.399847D+01
      2   0.413993D+00  0.228972D+01  0.163565D+02 -0.173736D+01 -0.980344D+00
      3   0.130938D+01 -0.257589D+01 -0.172062D+01  0.742742D+01 -0.170908D+01
               246           247           248           249           250 
      1  -0.750712D+01  0.533841D+01  0.928738D+01 -0.492432D+01 -0.587303D+01
      2   0.482010D-01 -0.179654D-01  0.228371D+01  0.712388D+00 -0.338896D+01
      3   0.604580D+01  0.451188D+01 -0.102025D+01 -0.750438D+01  0.109814D+02
               251           252           253           254           255 
      1  -0.274382D+01 -0.166149D+01  0.451083D+01  0.294328D+01 -0.103070D+01
      2  -0.111518D+00 -0.369915D+00 -0.134524D+02  0.137962D+02  0.135456D+02
      3  -0.816001D+01  0.617882D+01  0.182182D+02 -0.229235D+02 -0.141495D+02
               256           257           258           259           260 
      1   0.813592D+00 -0.144042D+02  0.401275D+01 -0.699044D+01  0.233347D+02
      2   0.521231D+01 -0.265597D+00  0.320911D+01 -0.162495D+01  0.122661D+02
      3  -0.421261D+01 -0.973713D+01  0.905094D+00 -0.751316D+01 -0.116747D+01
               261           262           263           264           265 
      1   0.145463D+02  0.552369D+01 -0.347283D+01 -0.389794D+01 -0.183471D+01
      2   0.106479D+02  0.741169D+01  0.680320D+00 -0.161329D+01 -0.237927D+01
      3  -0.279105D+01  0.127171D+02 -0.293864D+01 -0.570689D+01 -0.343484D+01
               266           267           268           269           270 
      1   0.279461D+01  0.335792D-01 -0.323051D+01  0.121508D+01  0.297624D+01
      2  -0.921262D+00  0.837684D+00 -0.885858D+00  0.243634D+00  0.353783D+00
      3   0.202753D+01  0.177694D+01 -0.263144D+01 -0.887599D-01  0.314894D+01
               271           272           273           274           275 
      1   0.135170D+01  0.821129D+00  0.397988D+01 -0.582442D+00  0.275219D+00
      2  -0.144291D+01  0.323546D+01 -0.509202D+01  0.128258D+01  0.519273D+00
      3  -0.473083D+00  0.302345D+01 -0.332250D+01  0.189739D+01  0.100032D+01
               276           277           278           279           280 
      1  -0.398165D+00  0.808710D+00  0.206956D+00  0.950868D+01 -0.688988D+01
      2  -0.203251D+00 -0.284328D+01  0.227211D+01 -0.836283D+01  0.256693D+01
      3   0.372916D+00 -0.135607D+01  0.211426D+01 -0.249833D+01  0.143250D+02
               281           282           283           284           285 
      1  -0.142548D+01 -0.552707D+01 -0.474380D+00 -0.125424D+01 -0.860213D+00
      2   0.567790D+00  0.363919D+01  0.693109D-01  0.520309D+00  0.958608D-01
      3  -0.733630D+00  0.587815D+01 -0.514684D-01  0.481870D+01 -0.313265D+00
               286           287           288           289           290 
      1  -0.648054D+01 -0.905763D+00 -0.884429D+01  0.628964D-01  0.294441D+00
      2   0.134817D+01  0.138103D+01  0.342068D+01  0.181901D+00  0.354070D+00
      3   0.984189D+01 -0.281891D+00  0.517729D+01  0.214140D+01  0.372596D+01
               291           292           293           294           295 
      1  -0.174805D+01  0.163784D+01  0.353983D+01 -0.696532D+01 -0.144094D+01
      2   0.745619D+00  0.250493D+00 -0.171284D+01  0.169921D+01 -0.810986D+00
      3  -0.108465D+01  0.507274D+01 -0.312017D+01  0.167620D+00 -0.728350D+00
               296           297           298           299           300 
      1  -0.147716D+01  0.680608D+01  0.211459D-01  0.115139D+00  0.146518D+01
      2   0.158823D+01 -0.170779D+01  0.151260D+00 -0.442314D+00  0.604525D+00
      3   0.403886D+01  0.234608D+00 -0.174257D+01  0.394426D+01  0.109207D+01
               301           302           303           304           305 
      1   0.146519D+01 -0.368998D+01 -0.710664D+01  0.133522D+01 -0.161026D+01
      2  -0.397288D+00 -0.151840D+01 -0.141643D+01 -0.939440D+00 -0.147865D+01
      3   0.529051D+01  0.271704D+01  0.115793D+00  0.905467D+00  0.400073D+01
               306           307           308           309           310 
      1  -0.687399D+01  0.689616D+01 -0.170517D+01  0.563571D+01 -0.723037D+00
      2  -0.140440D+01  0.223171D+01 -0.582659D+00  0.338158D+01 -0.121578D+00
      3  -0.235801D+00 -0.143440D+02 -0.300660D+00 -0.588403D+01  0.379345D+00
               311           312           313           314           315 
      1   0.137221D+01 -0.111892D+01  0.647828D+01 -0.124892D+01  0.898369D+01
      2   0.488193D+00 -0.212635D+00  0.996013D+00 -0.138183D+01  0.302315D+01
      3  -0.480051D+01 -0.509553D-01 -0.983934D+01  0.162000D+00 -0.517453D+01
               316           317           318           319           320 
      1  -0.541360D+01 -0.338075D+01  0.381882D+01 -0.161482D+01 -0.259956D+01
      2   0.770591D+01 -0.912512D+00 -0.182099D+01  0.206963D+01 -0.873127D+00
      3  -0.129718D+02 -0.244264D+01  0.579022D+01 -0.294788D+01 -0.176170D+01
               321           322           323           324           325 
      1  -0.173072D+00  0.323551D+01  0.105531D+01 -0.296406D+01 -0.140546D+01
      2  -0.759471D+00 -0.105436D+01 -0.259531D+00  0.475339D+00 -0.155083D+01
      3   0.152767D+01  0.263057D+01 -0.200713D+00 -0.314536D+01  0.685292D+00
               326           327           328           329           330 
      1   0.713621D+00 -0.421499D+01 -0.594012D+00 -0.240911D+00 -0.194783D+00
      2  -0.318013D+01 -0.488332D+01 -0.118052D+01  0.731873D+00  0.430636D+00
      3   0.294763D+01  0.333130D+01  0.182071D+01 -0.120685D+01  0.227594D+00
               331           332           333 
      1  -0.912307D+00  0.138946D+00 -0.985255D+01
      2  -0.287729D+01 -0.216284D+01 -0.791961D+01
      3   0.141878D+01  0.206753D+01  0.249011D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.085645:
                 1             2             3             4             5 
      1  -0.457232D+02 -0.788864D+01 -0.259632D+02 -0.241015D+01  0.188425D+02
      2   0.290650D+02  0.936601D+01  0.142911D+02  0.633053D+01 -0.965375D+01
      3   0.166582D+02 -0.147737D+01  0.116721D+02 -0.392037D+01 -0.918871D+01
      4  -0.190022D+02  0.889606D+01 -0.923130D+01  0.115709D+02  0.568577D+01
      5  -0.291721D+02 -0.238235D+01 -0.581184D+01  0.344774D+01 -0.886152D+01
      6  -0.803832D+01  0.595240D+01 -0.710277D-01  0.426090D+01 -0.958678D+01
                 6             7             8             9            10 
      1   0.752331D+01 -0.197801D+02  0.612703D+01 -0.951150D+00  0.105858D+02
      2  -0.998041D+01  0.113589D+02 -0.817091D+01 -0.358974D+01 -0.718964D+01
      3   0.245710D+01  0.842118D+01  0.204388D+01  0.454089D+01 -0.339619D+01
      4  -0.864999D+01 -0.442171D+01 -0.626088D+01 -0.432861D+01 -0.168448D+01
      5  -0.498997D+01 -0.678143D+01 -0.381015D+01  0.367393D+01  0.118477D+02
      6  -0.975677D+01 -0.216188D+00 -0.780114D+01  0.116406D+00  0.917360D+01
                11            12            13            14            15 
      1   0.221301D+01  0.145439D+02  0.210395D+00 -0.180947D+02 -0.276285D+01
      2  -0.112404D+02 -0.564594D+01 -0.120025D+02  0.415714D+01  0.106657D+02
      3   0.902738D+01 -0.889799D+01  0.117921D+02  0.139376D+02 -0.790285D+01
      4  -0.238584D+02  0.762211D+01 -0.295110D+02 -0.259391D+02  0.197513D+02
      5   0.215676D+00 -0.962693D+01  0.202069D+01  0.222885D+02  0.394308D+01
      6   0.528148D+01 -0.100028D+01  0.110286D+02  0.127442D+02 -0.307546D+01
                16            17            18            19            20 
      1   0.984582D+01 -0.445625D+01 -0.587535D+01  0.836697D+00  0.319048D+01
      2  -0.310100D+01  0.994698D+01  0.230114D+01 -0.445968D+01  0.187004D+01
      3  -0.674482D+01 -0.549073D+01  0.357421D+01  0.362298D+01 -0.506051D+01
      4   0.469019D+01  0.145416D+02  0.446743D+00  0.776624D+01  0.142325D+02
      5  -0.863359D+01  0.216253D+01 -0.289044D+01 -0.423643D+01 -0.275847D+01
      6  -0.153969D+01 -0.420933D+01 -0.326857D+01 -0.827590D+01 -0.678707D+01
                21            22            23            24            25 
      1  -0.714705D+01 -0.137811D+01  0.160189D+02 -0.838991D+00 -0.175100D+01
      2   0.465021D+01  0.408653D+01 -0.195788D+02  0.264900D+01  0.199696D+01
      3   0.249685D+01 -0.270842D+01  0.355986D+01 -0.181001D+01 -0.245958D+00
      4  -0.934350D+01  0.912136D+01  0.908006D+01 -0.522645D+01 -0.496382D+01
      5   0.484571D+01 -0.115742D+01 -0.705250D+01  0.279960D+01  0.515437D+01
      6   0.247018D+01 -0.688029D+01 -0.554429D+00  0.535823D+01  0.100013D+01
                26            27            28            29            30 
      1  -0.180000D+01  0.110935D+02 -0.103912D+02  0.769287D-01  0.468448D+01
      2   0.136469D+01  0.496684D+01  0.270271D+01 -0.657527D-01 -0.602390D+01
      3   0.435309D+00 -0.160604D+02  0.768852D+01 -0.111759D-01  0.133942D+01
      4  -0.218761D+01  0.180556D+01  0.417471D-01 -0.565797D+01 -0.359731D+00
      5   0.473387D+00  0.616105D+01  0.298134D+01 -0.214157D+00 -0.256676D+01
      6   0.355136D+01  0.617907D+01 -0.205038D+00 -0.348997D+01  0.302000D-03
                31            32            33            34            35 
      1  -0.270504D-01  0.217806D+01 -0.372600D+00  0.835275D+01 -0.554336D+00
      2   0.320113D-01 -0.916591D+01  0.411679D+00 -0.913747D+01  0.579513D+00
      3  -0.496092D-02  0.698785D+01 -0.390786D-01  0.784711D+00 -0.251770D-01
      4  -0.703821D+01 -0.868780D-02 -0.615985D+01 -0.581470D+00 -0.882394D+01
      5  -0.204144D+00 -0.366740D+01  0.106348D-01  0.482045D+01 -0.178010D-01
      6  -0.339020D+01  0.245754D+00 -0.211563D+01 -0.148700D-01  0.370923D+01
                36            37            38            39            40 
      1  -0.455512D+00  0.158538D+00 -0.131679D+01 -0.628862D+01  0.281165D+01
      2  -0.558318D+00 -0.410914D+01 -0.374154D+01  0.373150D+01 -0.551866D+01
      3   0.101383D+01  0.395060D+01  0.505833D+01  0.255712D+01  0.270701D+01
      4   0.354814D-02 -0.697651D+01  0.140725D+02  0.956055D+01  0.867268D+01
      5   0.967300D+00 -0.373066D+01  0.230402D+01  0.461203D+01  0.701271D+00
      6  -0.314428D-01  0.782754D+01 -0.717446D+01 -0.244405D+01 -0.720291D+01
                41            42            43            44            45 
      1   0.151048D+02  0.650156D+00 -0.124775D+01  0.166125D+01  0.109460D+02
      2  -0.183378D+02 -0.229710D+01  0.152870D+01 -0.118174D+01  0.511195D+01
      3   0.323309D+01  0.164694D+01 -0.280958D+00 -0.479513D+00 -0.160580D+02
      4  -0.116013D+02 -0.577059D+01  0.501848D+01 -0.253437D+01 -0.205207D+01
      5  -0.715397D+01 -0.273477D+01  0.508517D+01 -0.509462D+00  0.587258D+01
      6   0.151629D+01  0.558209D+01 -0.106965D+01  0.359982D+01 -0.648471D+01
                46            47            48            49            50 
      1   0.104005D+02 -0.536385D+01  0.140048D+02 -0.384442D+01 -0.154016D+02
      2  -0.611926D+01  0.136188D+02 -0.548975D+01  0.148766D+02  0.584941D+00
      3  -0.428125D+01 -0.825500D+01 -0.851510D+01 -0.110322D+02  0.148167D+02
      4  -0.131205D+01 -0.219550D+02 -0.761178D+01 -0.276290D+02  0.290530D+02
      5   0.113712D+02  0.475937D+00 -0.975527D+01 -0.107390D+01  0.217368D+02
      6  -0.896480D+01  0.506429D+01  0.129292D+01  0.108807D+02 -0.144056D+02
                51            52            53            54            55 
      1   0.384914D+01  0.963861D+01  0.528130D+01 -0.592526D+01 -0.433529D+02
      2  -0.121412D+02 -0.316583D+01 -0.110613D+02  0.236263D+01  0.265060D+02
      3   0.829203D+01 -0.647278D+01  0.578000D+01  0.356263D+01  0.168469D+02
      4   0.194199D+02 -0.460141D+01  0.140490D+02 -0.123354D+00  0.228938D+02
      5  -0.369914D+01 -0.865311D+01 -0.202108D+01 -0.271434D+01 -0.287573D+02
      6  -0.293757D+01  0.172571D+01 -0.415861D+01  0.339931D+01  0.969023D+01
                56            57            58            59            60 
      1   0.112323D+02 -0.254031D+02  0.597785D+01  0.176505D+02 -0.717071D+01
      2  -0.115980D+02  0.138528D+02 -0.879664D+01 -0.826909D+01  0.101086D+02
      3   0.365643D+00  0.115503D+02  0.281879D+01 -0.938142D+01 -0.293790D+01
      4   0.683903D+01  0.105496D+02  0.989188D+01 -0.767675D+01 -0.831173D+01
      5   0.348791D+01 -0.556456D+01 -0.242045D+01 -0.844409D+01  0.481543D+01
      6   0.585629D+01 -0.128974D+00  0.442410D+01  0.951587D+01 -0.997415D+01
                61            62            63            64            65 
      1  -0.195700D+02 -0.581627D+01 -0.532426D+00  0.106460D+02 -0.689262D+01
      2   0.112660D+02  0.819947D+01 -0.399111D+01 -0.101905D+02  0.600522D+01
      3   0.830401D+01 -0.238320D+01  0.452353D+01 -0.455438D+00  0.887402D+00
      4   0.546487D+01 -0.585432D+01  0.419336D+01 -0.209968D+02 -0.611230D+01
      5  -0.657022D+01  0.376705D+01  0.365507D+01  0.115762D+02 -0.527973D+01
      6   0.145598D+00 -0.799052D+01 -0.251562D+00 -0.373209D+01 -0.467299D+01
                66            67            68            69            70 
      1   0.658692D+01 -0.112154D+02 -0.876806D+01 -0.376003D+01  0.378237D+01
      2  -0.658655D+01  0.788839D+01  0.142126D+01  0.175155D+01 -0.296268D+01
      3  -0.373447D-03  0.332706D+01  0.734680D+01  0.200848D+01 -0.819687D+00
      4  -0.886079D+01  0.720805D-01 -0.462363D+01  0.688345D+01 -0.455119D+01
      5   0.801617D+01 -0.605421D+01  0.219791D+01 -0.159893D+01  0.469820D+01
      6  -0.144708D+01 -0.250148D+01 -0.203383D+01  0.318839D+01 -0.127956D+01
                71            72            73            74            75 
      1  -0.136495D+01  0.910042D+01  0.131315D+02  0.544438D+01  0.751564D+01
      2   0.299574D+01  0.819266D+01 -0.125181D+02 -0.489334D+01 -0.742679D+01
      3  -0.163080D+01 -0.172931D+02 -0.613350D+00 -0.551042D+00 -0.888478D-01
      4   0.237882D+01 -0.486969D+01  0.196786D+02 -0.728549D+01  0.854232D+01
      5  -0.205973D+01 -0.871320D+01  0.121926D+02  0.465859D+01  0.814665D+01
      6   0.374790D+01  0.818137D+00  0.291296D+01 -0.495000D+01  0.123295D+01
                76            77            78            79            80 
      1   0.103038D+02 -0.910319D+01  0.403655D+01  0.425534D+01  0.137221D+01
      2  -0.730841D+01  0.158707D+01 -0.202731D+01 -0.349537D+01 -0.303679D+01
      3  -0.299539D+01  0.751612D+01 -0.200924D+01 -0.759980D+00  0.166458D+01
      4  -0.140959D+01  0.538002D+01  0.625695D+01  0.431883D+01  0.199455D+01
      5   0.553078D+01  0.181427D+01  0.139022D+01  0.486648D+01  0.202063D+01
      6  -0.281190D+01  0.226421D+01  0.306900D+01  0.123798D+01  0.361118D+01
                81            82            83            84            85 
      1   0.954015D+01 -0.802273D+01 -0.373791D+01  0.108656D+02 -0.659616D+01
      2   0.776816D+01  0.111203D+02  0.366332D+01 -0.347135D+01  0.101577D+02
      3  -0.173083D+02 -0.309759D+01  0.745945D-01 -0.739421D+01 -0.356156D+01
      4   0.481939D+01 -0.688223D+01  0.222046D+01  0.585035D+01  0.199120D+01
      5  -0.875209D+01  0.957023D+01 -0.125014D+01 -0.260051D+01 -0.155850D+01
      6  -0.452263D+00  0.572905D+01 -0.465980D+01  0.497066D+01 -0.349715D+01
                86            87            88            89            90 
      1  -0.183561D+02  0.893794D+01  0.715536D+01  0.451934D+01  0.335241D+01
      2   0.189158D+02 -0.170624D+02 -0.931347D-01 -0.842046D+01  0.558909D+01
      3  -0.559739D+00  0.812444D+01 -0.706222D+01  0.390112D+01 -0.894150D+01
      4   0.513009D+01 -0.355395D+01  0.644667D+01 -0.272157D+01  0.299120D+01
      5  -0.751404D+01  0.192366D+01 -0.141636D+01  0.490063D+00 -0.188516D+01
      6  -0.130627D+02  0.475489D+01  0.386748D+01  0.196406D+01  0.733942D+01
                91            92            93            94            95 
      1  -0.210463D+01  0.198156D+01 -0.703070D+01  0.758993D+01  0.182864D+02
      2  -0.163480D+00 -0.361218D+01  0.437145D+01 -0.135598D+02 -0.246536D+02
      3   0.226811D+01  0.163062D+01  0.265925D+01  0.596987D+01  0.636723D+01
      4  -0.693267D+01 -0.350095D+01 -0.128570D+02 -0.468936D+01 -0.122799D+02
      5  -0.591085D+01 -0.161273D+01 -0.346066D+01 -0.116528D+01  0.753181D+01
      6  -0.130704D+02  0.372413D+01 -0.886830D+01  0.451398D+01  0.312821D+02
                96            97            98            99           100 
      1  -0.165140D+02 -0.986630D+01 -0.215019D+02  0.308474D+01  0.723734D+02
      2   0.314146D+02  0.812954D+01  0.350620D+02 -0.763087D+01 -0.391025D+02
      3  -0.149006D+02  0.173676D+01 -0.135602D+02  0.454613D+01 -0.332709D+02
      4   0.597974D+01 -0.142463D+02  0.928159D+01 -0.122190D+02 -0.333351D+02
      5  -0.520012D+00 -0.486513D+01 -0.364931D+01 -0.245470D+00  0.331452D+02
      6  -0.102156D+02 -0.120818D+02 -0.136793D+02  0.200048D+01 -0.101145D+02
               101           102           103           104           105 
      1  -0.104553D+02  0.202226D+02  0.211818D+01  0.556317D+01  0.228313D+01
      2   0.312466D+01 -0.133059D+02 -0.475975D+01 -0.172183D+01 -0.344933D+01
      3   0.733060D+01 -0.691661D+01  0.264157D+01 -0.384134D+01  0.116620D+01
      4   0.137817D+02 -0.960886D+01  0.105097D+02 -0.548825D+01  0.418962D+01
      5  -0.540408D+01  0.186802D+02  0.723305D+00  0.519318D+01 -0.685509D+00
      6   0.336334D+01 -0.658959D+01  0.289929D+01 -0.318650D+01  0.369672D+01
               106           107           108           109           110 
      1   0.154710D+02 -0.979109D+00  0.114020D+02 -0.238578D+01 -0.945847D+01
      2  -0.124396D+02 -0.431697D+00 -0.930930D+01  0.260022D+01  0.863855D+01
      3  -0.303135D+01  0.141081D+01 -0.209275D+01 -0.214436D+00  0.819918D+00
      4  -0.883648D+01  0.460050D+01 -0.741323D+01 -0.573229D+00 -0.101621D+01
      5   0.216280D+02 -0.447935D+01  0.136891D+02  0.330789D+01 -0.638204D+00
      6  -0.749863D+01  0.458324D+01 -0.489055D+01 -0.519776D+01 -0.590685D+01
               111           112           113           114           115 
      1   0.899040D+01 -0.552386D+01 -0.192560D+02  0.998006D+01  0.579907D+01
      2  -0.495482D+01  0.353306D+01  0.243716D+02 -0.933570D+01 -0.264187D+01
      3  -0.403558D+01  0.199080D+01 -0.511561D+01 -0.644356D+00 -0.315721D+01
      4  -0.203474D+01  0.475487D+01 -0.147408D+02  0.711066D+01 -0.467497D+01
      5  -0.828244D+00 -0.211420D+01  0.729770D+01 -0.890986D+01  0.334737D+01
      6   0.526312D+01 -0.454977D+00 -0.183494D+02  0.144969D+02  0.330043D+00
               116           117           118           119           120 
      1   0.772676D+01 -0.977373D+01  0.151324D+02 -0.100234D+02 -0.545645D+01
      2  -0.589623D+01  0.473474D+01 -0.412311D+00 -0.300213D+01  0.122928D+01
      3  -0.183053D+01  0.503899D+01 -0.147201D+02  0.130255D+02  0.422718D+01
      4   0.717815D+01 -0.548456D+01 -0.253635D+02  0.240942D+02  0.816116D+01
      5  -0.669233D+01  0.808863D+01 -0.113116D+02  0.759914D+01  0.897925D+01
      6   0.131573D+02 -0.133510D+02  0.749829D+01 -0.599660D+01 -0.478500D+01
               121           122           123           124           125 
      1  -0.911685D+01  0.603065D+00 -0.116806D+01 -0.391380D+01 -0.142426D+01
      2  -0.904886D+01  0.242746D+02  0.682004D+01  0.109368D+01  0.367302D+01
      3   0.181657D+02 -0.248776D+02 -0.565199D+01  0.282012D+01 -0.224876D+01
      4   0.346429D+02 -0.471851D+02 -0.160525D+02  0.937388D+01 -0.125750D+02
      5   0.106057D+02 -0.159844D+02 -0.103746D+02  0.121449D+02 -0.112163D+02
      6  -0.109129D+02  0.184796D+02  0.115871D+02 -0.839019D+01  0.124976D+02
               126           127           128           129           130 
      1   0.103717D+01  0.227073D+02  0.754372D+01 -0.101980D+02  0.158019D+02
      2   0.148293D+01 -0.162951D+02 -0.693884D+01  0.849269D+01 -0.135868D+02
      3  -0.252009D+01 -0.641219D+01 -0.604874D+00  0.170532D+01 -0.221513D+01
      4  -0.120515D+02  0.177340D+01  0.693398D+01 -0.361346D-01  0.700003D+01
      5  -0.918142D+01 -0.154748D+02 -0.397041D+01  0.128561D+02 -0.929837D+01
      6   0.874398D+01  0.110335D+01 -0.181954D+01 -0.206788D+01 -0.280093D+01
               131           132           133           134           135 
      1   0.898120D+01 -0.559399D+01 -0.988178D+01 -0.158493D+01  0.661244D+01
      2  -0.820085D+01  0.874282D+01  0.951401D+01  0.493593D+01 -0.108595D+02
      3  -0.780348D+00 -0.314883D+01  0.367769D+00 -0.335099D+01  0.424710D+01
      4   0.834286D+01 -0.732267D+01  0.176062D+01 -0.601386D+01  0.257850D+01
      5  -0.103059D+02  0.117607D+02  0.137229D+02  0.557677D+01 -0.151110D+02
      6  -0.160209D+01  0.382251D+00 -0.148926D+01  0.251312D+01  0.131811D+01
               136           137           138           139           140 
      1   0.183552D+02  0.115115D+02 -0.616812D+01  0.115410D+02  0.373106D+01
      2  -0.225708D+01  0.189039D+01  0.169282D+01  0.700158D+01  0.197570D+02
      3  -0.160981D+02 -0.134019D+02  0.447530D+01 -0.185426D+02 -0.234881D+02
      4   0.271643D+02  0.245986D+02 -0.855290D+01  0.354149D+02  0.454391D+02
      5  -0.124766D+02 -0.804960D+01  0.965202D+01 -0.112726D+02 -0.159544D+02
      6  -0.772599D+01 -0.610255D+01  0.487503D+01 -0.108887D+02 -0.170535D+02
               141           142           143           144           145 
      1   0.214756D-01 -0.471419D+01  0.520793D+00  0.208907D+01  0.215510D+02
      2  -0.548607D+01  0.178926D+01 -0.264964D+01  0.430069D+00 -0.152447D+02
      3   0.546459D+01  0.292493D+01  0.212885D+01 -0.251913D+01 -0.630633D+01
      4  -0.159961D+02 -0.969075D+01 -0.123624D+02  0.120422D+02 -0.279041D+01
      5   0.104751D+02  0.130178D+02  0.112133D+02 -0.957366D+01 -0.149326D+02
      6   0.109330D+02  0.838150D+01  0.116563D+02 -0.835364D+01 -0.647342D+00
               146           147           148           149           150 
      1  -0.750869D+01 -0.993614D+01 -0.157640D+02  0.923897D+01  0.537623D+01
      2   0.665690D+01  0.808506D+01  0.132834D+02 -0.831491D+01 -0.843567D+01
      3   0.851796D+00  0.185108D+01  0.248062D+01 -0.924056D+00  0.305944D+01
      4   0.728280D+01  0.502591D+00  0.799618D+01 -0.975955D+01 -0.795118D+01
      5   0.409312D+01  0.124069D+02  0.938212D+01 -0.108078D+02 -0.122723D+02
      6  -0.188070D+01  0.154508D+01 -0.309358D+01  0.227417D+01  0.830366D+00
               151           152           153           154           155 
      1  -0.994132D+01  0.148259D+01  0.635906D+01  0.753322D+02  0.865341D+01
      2   0.941993D+01 -0.480948D+01 -0.105762D+02 -0.416920D+02 -0.259500D+01
      3   0.521393D+00  0.332688D+01  0.421710D+01 -0.336401D+02 -0.605841D+01
      4  -0.118584D+01 -0.622758D+01 -0.332563D+01  0.294291D+02  0.121141D+02
      5   0.135127D+02 -0.604760D+01 -0.151102D+02  0.337346D+02  0.433744D+01
      6   0.100653D+01  0.271589D+01 -0.649765D+00  0.894538D+01  0.287681D+01
               156           157           158           159           160 
      1   0.209018D+02 -0.416040D+01  0.569610D+01 -0.280758D+01  0.162582D+02
      2  -0.139329D+02  0.553181D+01 -0.222327D+01  0.368047D+01 -0.131542D+02
      3  -0.696887D+01 -0.137141D+01 -0.347283D+01 -0.872880D+00 -0.310396D+01
      4   0.833070D+01  0.973486D+01  0.418785D+01  0.407601D+01  0.782145D+01
      5   0.189871D+02 -0.180562D+01  0.517182D+01  0.361616D-01  0.221440D+02
      6   0.594297D+01  0.267701D+01  0.271930D+01  0.341527D+01  0.676003D+01
               161           162           163           164           165 
      1   0.686206D+00  0.120188D+02 -0.171449D+01  0.865298D+01  0.873197D+01
      2   0.599115D+00 -0.992415D+01  0.206216D+01 -0.763098D+01 -0.473006D+01
      3  -0.128532D+01 -0.209464D+01 -0.347674D+00 -0.102200D+01 -0.400191D+01
      4   0.424119D+01  0.651052D+01  0.918242D+00 -0.112168D+01  0.176750D+01
      5   0.373689D+01  0.139151D+02  0.363880D+01  0.577414D+00 -0.640885D+00
      6   0.410491D+01  0.430992D+01  0.480306D+01 -0.536426D+01 -0.460607D+01
               166           167           168           169           170 
      1   0.525142D+01 -0.185481D+02 -0.970834D+01  0.588768D+01 -0.733460D+01
      2  -0.304818D+01  0.235506D+02  0.890171D+01 -0.280648D+01  0.537702D+01
      3  -0.220324D+01 -0.500256D+01  0.806630D+00 -0.308120D+01  0.195757D+01
      4   0.504353D+01  0.164392D+02  0.784108D+01  0.462917D+01  0.753819D+01
      5   0.229419D+01  0.795880D+01  0.955620D+01  0.364152D+01  0.709513D+01
      6   0.149479D-01  0.182730D+02  0.143019D+02  0.773212D-01  0.128562D+02
               171           172           173           174           175 
      1  -0.925626D+01  0.130609D+02 -0.631435D+01  0.497165D+00 -0.119906D+02
      2   0.423894D+01 -0.487771D+01  0.234501D+01 -0.852873D+00  0.653818D+01
      3   0.501732D+01 -0.818318D+01  0.396934D+01  0.355707D+00  0.545237D+01
      4   0.608287D+01 -0.112372D+02  0.116732D+02 -0.248540D+01  0.954531D+01
      5   0.863582D+01  0.367495D+01 -0.302446D+01  0.331030D+01 -0.861364D+01
      6   0.129666D+02 -0.316376D+01  0.380691D+01 -0.136057D+01  0.450909D+01
               176           177           178           179           180 
      1   0.456057D+01 -0.255577D+01 -0.613836D+01  0.111865D+01 -0.103557D+01
      2   0.804855D+00  0.394364D+01  0.297206D+01  0.817183D+00 -0.829996D+00
      3  -0.536542D+01 -0.138787D+01  0.316631D+01 -0.193583D+01  0.186556D+01
      4  -0.181700D+02  0.204344D+01 -0.196669D+01 -0.227124D+01 -0.386893D+01
      5   0.318083D+01 -0.581190D+01  0.349901D+00 -0.310998D+01  0.838774D+00
      6  -0.686029D+01  0.218249D+01 -0.123613D+01  0.961142D+00 -0.172737D+01
               181           182           183           184           185 
      1  -0.337881D+01 -0.195136D+00  0.357826D+01  0.210872D+00 -0.120802D+01
      2   0.919239D+00 -0.561236D+00  0.169101D+01 -0.122722D+00 -0.203105D+01
      3   0.245957D+01  0.756372D+00 -0.526927D+01 -0.881498D-01  0.323907D+01
      4  -0.277432D+01  0.591721D+00 -0.439435D+00  0.323445D+01 -0.220361D+00
      5  -0.992105D+00 -0.388079D+00  0.901820D+00 -0.505850D+00  0.301644D+01
      6   0.234388D+00  0.615650D+00 -0.553382D-01  0.168874D+01 -0.398664D+00
               186           187           188           189           190 
      1  -0.439387D-01  0.247682D+01  0.206783D+01 -0.177032D+02 -0.429622D+01
      2   0.755089D+00 -0.648051D+01  0.173029D+01 -0.198513D+02  0.591090D+01
      3  -0.711150D+00  0.400368D+01 -0.379812D+01  0.375545D+02 -0.161468D+01
      4   0.338063D+01  0.142881D+01  0.454826D+01 -0.369681D+01 -0.482570D+01
      5  -0.647921D+00  0.875905D+01 -0.247818D+01  0.241481D+02  0.306488D+01
      6   0.560255D+01  0.263928D+00  0.354500D+01  0.857426D+00  0.235103D+00
               191           192           193           194           195 
      1   0.683179D+01 -0.185438D+01  0.701667D+01 -0.209458D+02  0.473297D+01
      2  -0.870065D+01  0.119139D+01 -0.672498D+01  0.323234D+02 -0.398523D+01
      3   0.186885D+01  0.662993D+00 -0.291695D+00 -0.113776D+02 -0.747736D+00
      4   0.761851D+00  0.178686D+01  0.616044D+01  0.210257D+01 -0.648381D+00
      5  -0.490350D+00 -0.673110D+00 -0.292050D+01  0.190714D+01  0.108762D+01
      6   0.654766D+01 -0.315912D+01  0.140645D+01 -0.122830D+02  0.662880D+01
               196           197           198           199           200 
      1   0.162271D+01  0.747068D+00 -0.452104D+01 -0.586346D+00  0.146293D+01
      2  -0.135112D+01  0.299715D+01  0.247559D+01 -0.255849D+01 -0.105157D+01
      3  -0.271598D+00 -0.374422D+01  0.204545D+01  0.314483D+01 -0.411355D+00
      4   0.322193D+01  0.358653D+01 -0.164703D+01  0.425887D+00 -0.528341D+00
      5  -0.890042D+00 -0.114436D+00  0.593820D+00 -0.186700D+01 -0.276373D-01
      6  -0.213429D+01  0.285957D+01 -0.196821D+01 -0.643528D+00  0.208955D+01
               201           202           203           204           205 
      1  -0.340086D+01 -0.121118D+01 -0.393158D+01  0.220049D+00 -0.322457D+01
      2   0.928651D+00  0.110543D+01  0.149725D+01 -0.454073D+01  0.295572D+01
      3   0.247221D+01  0.105750D+00  0.243433D+01  0.432068D+01  0.268846D+00
      4  -0.108913D+01 -0.179841D+01 -0.312956D+01 -0.527692D-01 -0.412117D+01
      5   0.411045D+01  0.849636D+00  0.346003D+00 -0.218307D+01  0.417312D+01
      6  -0.176180D+01  0.174535D+01 -0.825035D+00  0.243523D+01  0.956448D+00
               206           207           208           209           210 
      1   0.498002D+01 -0.215180D+02 -0.444808D+01 -0.743710D+01 -0.218633D+01
      2  -0.136976D+00 -0.149609D+02  0.615635D+01  0.974234D+01  0.150021D+01
      3  -0.484304D+01  0.364789D+02 -0.170827D+01 -0.230524D+01  0.686127D+00
      4  -0.298410D+01 -0.459852D+00  0.563236D+01  0.121097D+01 -0.166170D+01
      5   0.335387D+01 -0.149873D+02  0.322772D+01  0.742343D+00 -0.568019D+00
      6   0.784583D+01 -0.192672D+02 -0.170207D-01  0.702376D+01  0.346276D+01
               211           212           213           214           215 
      1  -0.716858D+01 -0.204030D+02 -0.464927D+01  0.132988D+01 -0.461008D+00
      2   0.731118D+01  0.317188D+02  0.392538D+01 -0.121892D+01 -0.330425D+01
      3  -0.142603D+00 -0.113158D+02  0.723895D+00 -0.110966D+00  0.376526D+01
      4   0.650575D+01 -0.104422D+00 -0.190404D+00 -0.319585D+01  0.361587D+01
      5   0.294320D+01  0.228655D+01 -0.772939D+00 -0.792926D+00  0.267203D+00
      6   0.180310D+01  0.117513D+02  0.649424D+01  0.228935D+01  0.274076D+01
               216           217           218           219           220 
      1  -0.435410D+01 -0.658364D+00 -0.164352D+01 -0.331475D+01  0.911931D+00
      2   0.232164D+01 -0.249920D+01  0.126208D+01  0.102018D+01 -0.770235D+00
      3   0.203246D+01  0.315757D+01  0.381445D+00  0.229458D+01 -0.141696D+00
      4   0.194523D+01 -0.603324D+00 -0.241913D+00  0.128724D+01 -0.171133D+01
      5   0.680307D+00 -0.185570D+01  0.222982D+00  0.426978D+01 -0.663790D+00
      6   0.191545D+01  0.903009D+00  0.208811D+01  0.169284D+01  0.177299D+01
               221           222           223           224           225 
      1  -0.363131D+01 -0.979465D-01 -0.309045D+01 -0.513551D+01 -0.214785D+02
      2   0.121078D+01  0.447745D+01  0.259127D+01  0.270277D+00 -0.149688D+02
      3   0.242053D+01 -0.437951D+01  0.499178D+00  0.486523D+01  0.364473D+02
      4   0.343742D+01  0.102570D+00  0.425690D+01 -0.294050D+01  0.729612D+00
      5   0.402687D+00  0.207705D+01  0.397851D+01 -0.319870D+01 -0.140974D+02
      6   0.660706D+00  0.229019D+01 -0.782053D+00  0.806030D+01  0.199514D+02
               226           227           228           229           230 
      1   0.147914D+02  0.689866D+01  0.821884D+00  0.123655D+02  0.525050D+01
      2  -0.623018D+01 -0.307538D+01 -0.122903D+01 -0.706568D+01 -0.299749D+00
      3  -0.856123D+01 -0.382328D+01  0.407144D+00 -0.529980D+01 -0.495075D+01
      4   0.112763D+02  0.115285D+02  0.248506D+01  0.897449D+01  0.170632D+02
      5   0.430356D+01  0.313749D+01  0.360520D+01  0.874845D+01  0.295477D+01
      6   0.333166D+01  0.380839D+01  0.130009D+01  0.427177D+01  0.637538D+01
               231           232           233           234           235 
      1   0.267675D+01 -0.599471D+01 -0.105796D+01 -0.703889D+00 -0.311026D+01
      2  -0.405208D+01  0.275421D+01 -0.737847D+00 -0.116072D+01  0.681922D+00
      3   0.137533D+01  0.324050D+01  0.179580D+01  0.186461D+01  0.242834D+01
      4   0.164935D+01  0.225977D+01 -0.234593D+01  0.386150D+01  0.310395D+01
      5   0.574622D+01  0.534206D+00  0.312440D+01  0.909906D+00 -0.954469D+00
      6   0.187520D+01  0.125180D+01  0.774371D+00  0.169448D+01 -0.939864D-01
               236           237           238           239           240 
      1   0.322364D+00  0.362692D+01  0.147472D+00 -0.120750D+01  0.175601D+00
      2   0.400287D+00  0.161436D+01 -0.269867D+00 -0.205698D+01 -0.111489D+01
      3  -0.722651D+00 -0.524127D+01  0.122394D+00  0.326448D+01  0.939289D+00
      4   0.481374D+00  0.499413D+00  0.310798D+01  0.219743D-01  0.331311D+01
      5   0.582895D+00  0.938342D+00  0.745938D+00  0.297644D+01  0.844929D+00
      6   0.614987D+00  0.254862D+00  0.167887D+01  0.170163D+00  0.556045D+01
               241           242           243           244           245 
      1   0.225807D+01 -0.177194D+01 -0.173817D+02 -0.189968D+01 -0.133997D+01
      2  -0.642100D+01 -0.184758D+01 -0.201574D+02 -0.443855D-01  0.277549D+01
      3   0.416293D+01  0.361953D+01  0.375391D+02  0.194407D+01 -0.143552D+01
      4  -0.161354D+01  0.461936D+01  0.358049D+01  0.669624D+01 -0.307942D+01
      5   0.883851D+01  0.224525D+01  0.240579D+02 -0.516810D+01  0.228098D+01
      6  -0.492600D+00  0.345747D+01 -0.189354D+01  0.135953D+02  0.164251D+01
               246           247           248           249           250 
      1  -0.511329D+01 -0.702639D+01  0.197219D+02  0.171963D+02 -0.757508D+01
      2   0.180061D+01  0.127967D+02 -0.264467D+02 -0.319698D+02  0.524406D+01
      3   0.331268D+01 -0.577030D+01  0.672478D+01  0.147736D+02  0.233102D+01
      4   0.134726D+02 -0.358092D+01  0.106474D+02  0.324904D+01  0.152731D+02
      5  -0.305682D+01  0.186575D+01  0.597573D+01  0.199588D+00 -0.418114D+01
      6   0.854594D+01  0.245830D+01 -0.318633D+02 -0.106049D+02  0.116516D+02
               251           252           253           254           255 
      1   0.225795D+02  0.414133D+01 -0.690343D+01  0.338627D+01  0.990230D+01
      2  -0.360638D+02 -0.868273D+01  0.985946D+01 -0.341904D+01 -0.215255D+01
      3   0.134843D+02  0.454139D+01 -0.295603D+01  0.327721D-01 -0.774975D+01
      4   0.607330D+01  0.116877D+02  0.781593D+01  0.137727D+01 -0.657855D+01
      5   0.322283D+01 -0.332518D+00  0.939128D+01  0.303260D+00 -0.291683D+01
      6  -0.143379D+02 -0.198598D+01 -0.649566D+01 -0.381500D+01 -0.461857D+01
               256           257           258           259           260 
      1   0.621781D+01 -0.191800D+02 -0.965195D+01  0.635824D+01 -0.504024D+01
      2  -0.987834D+01  0.198976D+02  0.174341D+02  0.873536D+00  0.862739D+01
      3   0.366053D+01 -0.717667D+00 -0.778218D+01 -0.723178D+01 -0.358715D+01
      4   0.743547D+00 -0.358474D+01 -0.210835D+01 -0.684851D+01 -0.183952D+01
      5   0.664134D+00 -0.700141D+01 -0.158037D+01 -0.162271D+01 -0.336871D+00
      6  -0.268209D+01  0.137021D+02  0.503324D+01 -0.371246D+01  0.213977D+01
               261           262           263           264           265 
      1   0.308477D+01  0.180328D+02 -0.282917D+01 -0.595995D+01 -0.591881D+00
      2   0.584581D+01 -0.159954D+02  0.598507D+01  0.830218D+01  0.250651D+01
      3  -0.893058D+01 -0.203739D+01 -0.315590D+01 -0.234223D+01 -0.191463D+01
      4  -0.288381D+01  0.157597D+02  0.646274D+01 -0.777883D+01  0.127823D+01
      5  -0.221378D+01 -0.183219D+02 -0.306829D+01  0.114201D+02  0.229555D+01
      6  -0.724926D+01 -0.750903D+01 -0.361887D+01  0.669017D+01 -0.278793D+00
               266           267           268           269           270 
      1   0.416554D+01 -0.546261D+00 -0.330372D+01 -0.570275D+00  0.147339D+01
      2  -0.281246D+01 -0.499111D+00  0.678492D+01  0.166017D+01 -0.746868D+01
      3  -0.135308D+01  0.104537D+01 -0.348120D+01 -0.108989D+01  0.599529D+01
      4   0.407014D+00  0.273163D+00 -0.300605D+01 -0.305057D+00  0.339235D+01
      5  -0.352686D+00 -0.131627D+01  0.829820D+01  0.225981D+00 -0.756029D+01
      6   0.138722D+01 -0.747559D-01  0.352481D+01  0.136139D+01 -0.514027D+01
               271           272           273           274           275 
      1  -0.163931D+00  0.658252D+01 -0.774389D+01  0.191624D+01 -0.196100D+01
      2  -0.458870D+01 -0.650520D+01 -0.202269D+01 -0.196577D+01 -0.637765D+00
      3   0.475263D+01 -0.773253D-01  0.976657D+01  0.495244D-01  0.259877D+01
      4  -0.369199D+01 -0.770313D+00 -0.354850D+01 -0.361649D-01 -0.207867D+01
      5   0.188680D+01  0.235520D+00  0.365516D+01  0.121046D-01  0.218224D+01
      6  -0.254147D+01  0.572963D+01 -0.894734D+01  0.243397D+01 -0.261800D+01
               276           277           278           279           280 
      1   0.170238D+01 -0.238363D+01  0.669450D+01 -0.159789D+02  0.122550D+02
      2  -0.748036D+00 -0.121352D+01 -0.235065D+01 -0.129454D+02 -0.250787D+01
      3  -0.954340D+00  0.359715D+01 -0.434385D+01  0.289244D+02 -0.974711D+01
      4   0.130672D+01 -0.338446D+01 -0.950931D+00 -0.321671D+01  0.256287D+02
      5  -0.940408D+00  0.394309D+01  0.370577D+00 -0.141737D+01  0.766930D+01
      6   0.536770D+01 -0.158755D+01  0.805528D+01 -0.211819D+02  0.982172D+01
               281           282           283           284           285 
      1  -0.227668D+01  0.463226D+01 -0.343727D+01 -0.172999D+01 -0.776055D+00
      2   0.101450D+02 -0.122544D+01  0.755025D+01  0.596617D+01  0.867320D+00
      3  -0.786835D+01 -0.340682D+01 -0.411299D+01 -0.423619D+01 -0.912647D-01
      4   0.122412D+02  0.974944D+01  0.649537D+01  0.886215D+01  0.192585D+01
      5   0.175893D+01  0.636781D+01  0.709208D+00  0.178506D+01  0.788945D+00
      6   0.307326D+01  0.867413D+01  0.122331D+01  0.159613D+01  0.355152D+01
               286           287           288           289           290 
      1   0.505747D+01 -0.831455D+00  0.620363D+00 -0.338343D+01 -0.956683D+00
      2  -0.212188D+01  0.417432D+01  0.623515D+00  0.856900D+01  0.603727D+01
      3  -0.293559D+01 -0.334286D+01 -0.124388D+01 -0.518557D+01 -0.508059D+01
      4   0.158227D+02  0.625024D+01  0.106806D+02  0.822955D+01  0.158633D+02
      5   0.795623D+01  0.326858D+01  0.765554D+01 -0.153709D+01 -0.348818D+01
      6   0.110758D+02  0.817346D+01  0.133480D+02 -0.471453D+01 -0.451101D+01
               291           292           293           294           295 
      1   0.106407D+01 -0.511438D+01 -0.379030D+02  0.136029D+02  0.450298D+01
      2  -0.241163D+01  0.118974D+02  0.670724D+02 -0.215672D+02 -0.672720D+01
      3   0.134757D+01 -0.678300D+01 -0.291694D+02  0.796433D+01  0.222421D+01
      4  -0.501518D+01  0.124134D+02  0.203846D+02 -0.779186D+01 -0.584743D+01
      5   0.377633D+01 -0.187462D+01 -0.494892D+01  0.309046D+01  0.410472D+01
      6   0.361863D+01 -0.642902D+01 -0.306757D+02  0.184878D+02  0.772561D+01
               296           297           298           299           300 
      1   0.210504D+02 -0.135521D+02 -0.378271D+01  0.760963D+00  0.867773D+00
      2  -0.305689D+02  0.165112D+02  0.849218D+01 -0.475616D+01 -0.185986D+01
      3   0.951844D+01 -0.295905D+01 -0.470948D+01  0.399519D+01  0.992086D+00
      4  -0.114320D+02  0.846242D+01 -0.648448D+01  0.150870D+02  0.455954D+01
      5   0.542885D+01 -0.450108D+01 -0.111311D+01  0.317209D+01  0.350566D+01
      6   0.276045D+02 -0.214948D+02  0.433200D+01 -0.347760D+01 -0.295001D+01
               301           302           303           304           305 
      1   0.459665D+01 -0.398203D+02 -0.142699D+02  0.401946D+01 -0.221582D+02
      2  -0.102963D+02  0.694845D+02  0.222872D+02 -0.582064D+01  0.317719D+02
      3   0.569962D+01 -0.296642D+02 -0.801726D+01  0.180118D+01 -0.961368D+01
      4   0.112055D+02 -0.168480D+02 -0.641101D+01  0.491617D+01 -0.932817D+01
      5   0.147676D+01 -0.379258D+01 -0.242371D+01  0.356690D+01 -0.436009D+01
      6  -0.532724D+01  0.312952D+02  0.187479D+02 -0.665649D+01  0.281322D+02
               306           307           308           309           310 
      1  -0.142357D+02  0.102617D+02  0.276513D+01  0.379150D+01  0.342925D+01
      2   0.172011D+02 -0.105360D+01 -0.108542D+02 -0.391412D+00 -0.776136D+01
      3  -0.296542D+01 -0.920812D+01  0.808906D+01 -0.340009D+01  0.433211D+01
      4  -0.709686D+01 -0.253868D+02  0.123974D+02 -0.988577D+01  0.672692D+01
      5  -0.354043D+01  0.711832D+01 -0.186638D+01  0.594395D+01 -0.898219D+00
      6   0.216584D+02 -0.994523D+01  0.352450D+01 -0.878207D+01  0.161602D+01
               311           312           313           314           315 
      1  -0.280508D+01  0.772162D+00  0.369864D+01  0.120808D+01 -0.325645D+00
      2   0.758099D+01 -0.101317D+01 -0.917383D+00 -0.467204D+01  0.156097D+01
      3  -0.477591D+01  0.241009D+00 -0.278126D+01  0.346396D+01 -0.123533D+01
      4  -0.929507D+01  0.228067D+01 -0.158005D+02  0.671379D+01 -0.106376D+02
      5   0.182320D+01 -0.894370D+00  0.732301D+01 -0.323060D+01  0.705717D+01
      6  -0.187875D+01  0.397248D+01 -0.110378D+02  0.880347D+01 -0.136729D+02
               316           317           318           319           320 
      1   0.167104D+02  0.281847D+01 -0.521477D+01  0.139914D+00  0.395557D+01
      2  -0.149075D+02 -0.599629D+01  0.760474D+01 -0.207327D+01 -0.237327D+01
      3  -0.180297D+01  0.317782D+01 -0.238997D+01  0.193335D+01 -0.158231D+01
      4  -0.168730D+02  0.677362D+01  0.839861D+01  0.185663D+01 -0.106708D+01
      5  -0.179204D+02  0.369164D+01  0.111723D+02 -0.152658D+01 -0.480091D+00
      6   0.813684D+01 -0.417795D+01 -0.719862D+01 -0.602387D+00 -0.117392D+01
               321           322           323           324           325 
      1   0.800345D+00 -0.299020D+01  0.667644D+00  0.115332D+01 -0.235865D+00
      2   0.138277D+00  0.642471D+01 -0.191191D+01 -0.715401D+01 -0.451912D+01
      3  -0.938623D+00 -0.343451D+01  0.124427D+01  0.600070D+01  0.475499D+01
      4  -0.104260D+00  0.343097D+01 -0.558148D+00 -0.378594D+01  0.348861D+01
      5   0.815243D+00  0.812963D+01 -0.532990D+00 -0.733746D+01  0.200439D+01
      6   0.189407D+00 -0.383531D+01  0.154952D+01  0.548406D+01  0.282284D+01
               326           327           328           329           330 
      1  -0.669589D+01 -0.748521D+01 -0.197945D+01 -0.138890D+01 -0.124872D+01
      2   0.671373D+01 -0.231942D+01  0.212617D+01 -0.121003D+01  0.729933D+00
      3  -0.178364D-01  0.980463D+01 -0.146720D+00  0.259893D+01  0.518790D+00
      4  -0.246383D+00  0.385300D+01  0.744066D-01  0.213307D+01  0.124281D+01
      5   0.351748D-01  0.409805D+01  0.111409D+00  0.229387D+01  0.995170D+00
      6   0.572156D+01  0.900908D+01  0.242108D+01  0.215807D+01  0.492635D+01
               331           332           333 
      1  -0.238624D+01 -0.664760D+01 -0.156756D+02
      2  -0.141034D+01  0.247044D+01 -0.132243D+02
      3   0.379658D+01  0.417716D+01  0.289000D+02
      4   0.340357D+01 -0.693777D+00  0.334731D+01
      5   0.400308D+01 -0.181799D+00 -0.461291D+00
      6   0.177921D+01  0.798664D+01  0.212137D+02

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.144143D-01      0.366374D-01      0.122209D+00
   x          0.658671D-03      0.167418D-02      0.558445D-02
   y          0.143809D-01      0.365526D-01      0.121926D+00
   z          0.725989D-03      0.184528D-02      0.615519D-02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.139458D+03      0.206655D+02      0.229935D+02
   aniso      0.282557D+02      0.418706D+01      0.465873D+01
   xx         0.149422D+03      0.221421D+02      0.246364D+02
   yx        -0.441725D-02     -0.654570D-03     -0.728307D-03
   yy         0.148320D+03      0.219787D+02      0.244546D+02
   zx        -0.453560D-01     -0.672107D-02     -0.747820D-02
   zy        -0.468236D-04     -0.693854D-05     -0.772017D-05
   zz         0.120632D+03      0.178758D+02      0.198895D+02

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.146555D+03      0.217172D+02      0.241636D+02
   aniso      0.305692D+02      0.452989D+01      0.504018D+01
   xx         0.157335D+03      0.233147D+02      0.259411D+02
   yx        -0.354420D-02     -0.525197D-03     -0.584360D-03
   yy         0.156142D+03      0.231378D+02      0.257443D+02
   zx        -0.259076D-01     -0.383911D-02     -0.427159D-02
   zy        -0.674529D-03     -0.999548D-04     -0.111215D-03
   zz         0.126187D+03      0.186990D+02      0.208054D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6         -4.63170140          1.56519360         -2.77330559
     6         -4.63491925         -1.28260134         -2.93006991
     7         -1.94868331         -2.20046724         -2.72415828
    45         -0.00033715          0.00025888          0.00223332
     7          2.06738136          1.91138398         -2.85031279
     6          4.75860935          0.98506499         -2.84288536
     6          4.74403713         -1.83123877         -2.39211776
     7          3.24147205         -2.35582258         -0.03335288
     7         -3.23342707          2.33310036         -0.41702454
     7          1.56310870          2.20941609          2.96034269
     6          1.18659769          0.86180546          5.43712811
     1          6.65944756         -2.56771819         -2.20264289
     1          3.84681089         -2.83895626         -3.94943791
     1          5.68506960          1.45299991         -4.62308593
     1          5.76803186          1.97940847         -1.34663991
     1         -5.48456994         -1.93423556         -4.69069712
     1         -5.71129724         -2.11756751         -1.38388476
     1         -6.55143104          2.31420944         -2.74583374
     1         -3.66379171          2.40780667         -4.38551415
     1         -4.42914598          2.17120471          1.08583249
     1         -2.84040798          4.21706091         -0.52205729
     1         -1.12845012         -2.09360158         -4.46469920
     1         -1.96699633         -4.08495861         -2.32070815
     1          1.32294939          1.62058459         -4.60378038
     1          2.07102177          3.82770644         -2.64543478
     1          4.36920616         -2.03755754          1.49673061
     1          2.84870975         -4.24138187          0.03829273
     6         -1.41829863         -0.30062832          5.44156318
     7         -1.69189832         -1.89654938          3.10276797
     1          3.42959843          2.64421984          2.76086658
     1          0.68108274          3.92080934          3.05632857
     1          2.64719557         -0.58231926          5.60950426
     1          1.42451777          2.17010910          7.01149378
     1         -1.72544698         -1.44075577          7.13056109
     1         -2.88217764          1.14983129          5.40223913
     1         -3.54901260         -2.35495197          2.87094007
     1         -0.81737675         -3.58656429          3.41140659

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.144143D-01      0.366374D-01      0.122209D+00
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.144143D-01      0.366374D-01      0.122209D+00

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.139458D+03      0.206655D+02      0.229935D+02
   aniso      0.282557D+02      0.418706D+01      0.465873D+01
   xx         0.149365D+03      0.221336D+02      0.246269D+02
   yx        -0.126523D+01     -0.187488D+00     -0.208609D+00
   yy         0.120758D+03      0.178945D+02      0.199103D+02
   zx         0.107439D+00      0.159209D-01      0.177144D-01
   zy         0.139152D+01      0.206201D+00      0.229430D+00
   zz         0.148251D+03      0.219686D+02      0.244433D+02

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  532.0nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.146555D+03      0.217172D+02      0.241636D+02
   aniso      0.305692D+02      0.452989D+01      0.504018D+01
   xx         0.157271D+03      0.233051D+02      0.259305D+02
   yx        -0.139182D+01     -0.206247D+00     -0.229481D+00
   yy         0.126326D+03      0.187195D+02      0.208283D+02
   zx         0.118641D+00      0.175808D-01      0.195613D-01
   zy         0.150490D+01      0.223003D+00      0.248124D+00
   zz         0.156068D+03      0.231269D+02      0.257321D+02

 ----------------------------------------------------------------------
 1\1\GINC-CPN-F16-26\Freq\RB3LYP\Gen\C6H24N6Rh1(3+)\PIERPA\08-Jul-2021\
 0\\#P B3LYP/Gen EmpiricalDispersion=GD3BJ Integral=UltraFineGrid SCF=(
 NoSymm,MaxCyc=120) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq Pseudo=
 Read\\ROA calculations.\\3,1\C,-2.54913,-1.314427,-0.788263\C,-2.48921
 1,-1.476014,0.711136\N,-1.044481,-1.45443,1.136257\Rh,-0.00013,0.00119
 4,-0.000069\N,0.979011,-1.499359,-1.135079\C,2.421772,-1.582914,-0.710
 906\C,2.489662,-1.42262,0.788334\N,1.765206,-0.157327,1.16449\N,-1.771
 326,-0.081265,-1.164692\N,0.846355,1.588228,-1.125363\C,0.738354,2.867
 165,-0.338772\H,3.522736,-1.386984,1.135893\H,2.001302,-2.252121,1.300
 55\H,2.857264,-2.53109,-1.027803\H,2.968216,-0.788605,-1.220402\H,-2.9
 6554,-2.404079,1.028788\H,-3.001107,-0.658112,1.219196\H,-3.579527,-1.
 235079,-1.136554\H,-2.096291,-2.164483,-1.299497\H,-2.362756,0.73515,-
 1.01025\H,-1.609574,-0.09355,-2.171636\H,-0.655838,-2.389231,1.013613\
 H,-1.001113,-1.293216,2.142374\H,0.550136,-2.416064,-1.010284\H,0.9418
 73,-1.338186,-2.141433\H,2.39048,0.633399,1.009972\H,1.602819,-0.16271
 9,2.171382\C,-0.610551,2.897132,0.338045\N,-0.774945,1.62443,1.124896\
 H,1.817285,1.45209,-1.405369\H,0.343548,1.706576,-2.00501\H,1.54707,2.
 884615,0.392932\H,0.872026,3.729136,-0.993286\H,-0.705735,3.76431,0.99
 2421\H,-1.417928,2.950178,-0.393378\H,-1.750811,1.531991,1.405639\H,-0
 .266808,1.720469,2.004222\\Version=ES64L-G16RevA.03\State=1-A\HF=-681.
 6354694\RMSD=3.890e-09\RMSF=2.632e-05\ZeroPoint=0.3526878\Thermal=0.36
 76943\Dipole=0.0006587,0.0143809,0.000726\DipoleDeriv=0.0940715,0.0928
 847,-0.0801248,0.2904907,0.3900308,-0.0272669,-0.1963252,-0.0990829,0.
 1104572,0.4733916,0.0476944,0.0781914,-0.147664,0.0067253,0.0494566,0.
 197745,0.1159605,0.1242762,-0.3757472,-0.1564402,-0.0146531,-0.1539459
 ,-0.2377096,0.1210753,0.0709022,0.2201774,-0.2498529,1.1116318,-0.0004
 553,0.0002119,-0.0006437,1.0591387,0.0001893,-0.0129893,0.000652,0.707
 6141,-0.3619446,0.1617723,-0.0198099,0.1591361,-0.2517053,-0.1204789,0
 .0612112,-0.2233556,-0.2495741,0.4768065,-0.0679349,0.0757218,0.127498
 3,0.0031314,-0.0527936,0.192046,-0.1242248,0.1242858,0.0782432,-0.0795
 898,-0.0788043,-0.2773611,0.4059623,0.0305827,-0.1915062,0.1072591,0.1
 104799,-0.4015528,0.1291803,-0.1054135,0.134805,-0.2175505,-0.0692585,
 -0.2303075,-0.0494812,-0.2472725,-0.4126115,-0.1208105,-0.1021679,-0.1
 261312,-0.2066859,0.0739595,-0.227596,0.0592578,-0.2473368,-0.1723762,
 -0.1522266,0.1343829,-0.0861082,-0.4590469,0.0150735,0.1542243,0.08402
 14,-0.2381255,0.1238213,-0.0899613,0.0137872,-0.0339178,0.3195108,0.14
 58983,0.0455338,0.3791272,0.1550892,0.0957036,0.0053564,0.0080307,0.02
 29336,0.0635952,-0.0123789,0.0334661,-0.0256591,0.1084877,0.0317631,-0
 .0655628,0.0773797,-0.0255581,0.0246261,-0.0104291,0.0614753,-0.012483
 5,0.0407659,0.0599273,0.0019425,-0.0164798,-0.0145767,0.1005262,0.0013
 929,-0.0387573,0.017576,0.1065802,0.0638319,-0.0126199,-0.04308,-0.053
 9228,-0.0076827,0.0667543,-0.0363142,0.0519501,0.0353073,0.0605136,-0.
 0002543,-0.0165518,0.016324,0.0999114,-0.0006456,-0.039569,-0.0158303,
 0.1065432,0.0665419,0.0093302,-0.0459,0.0506832,-0.0105392,-0.0647207,
 -0.0385001,-0.0501897,0.035397,0.0943436,-0.0067031,0.008533,-0.024269
 6,0.0648829,0.0120543,0.0345739,0.0241982,0.1084662,0.0355656,0.065177
 1,0.0777442,0.0251901,0.0206431,0.0070903,0.0619714,0.0098486,0.040787
 4,0.1548744,-0.0086622,0.0136187,-0.0516805,0.1434999,-0.0241272,0.004
 8362,-0.0251151,0.1457679,0.1160585,-0.0067416,0.007732,-0.0214695,0.1
 497932,0.0119649,0.0511869,0.0132665,0.2170395,0.112209,-0.0244523,0.0
 191638,0.0182372,0.1764576,-0.0251809,0.0210935,-0.0232402,0.1486799,0
 .1286896,-0.0275806,-0.0145002,-0.015508,0.1364761,-0.0007481,-0.04008
 49,-0.037438,0.219949,0.1128204,0.0270777,0.0202008,-0.0154085,0.17606
 94,0.0242678,0.0220964,0.0223244,0.148501,0.1306138,0.0278971,-0.01444
 08,0.0157202,0.134635,0.001376,-0.0383462,0.0392204,0.2200455,0.157400
 6,0.0079247,0.0146842,0.0507974,0.1409222,0.0233299,0.0061153,0.024733
 2,0.1457508,0.1173426,0.0081416,0.0072426,0.0227931,0.1484611,-0.01237
 95,0.0505386,-0.0155169,0.2170859,0.1296263,0.0982071,0.0072838,0.0423
 274,0.3135273,-0.1463442,0.0286486,-0.3807477,0.1551467,-0.1623662,0.1
 392165,0.1335965,0.0729984,-0.4691106,-0.0209312,0.1502839,-0.0906136,
 -0.2379272,0.1861889,0.0295989,-0.0247207,-0.0087743,0.1290826,-0.0105
 651,-0.0115314,-0.0299058,0.1658287,0.1311037,-0.0320241,-0.0136046,-0
 .0208049,0.1101916,-0.0133591,-0.0179135,-0.0532814,0.2088785,0.007909
 9,0.0535465,-0.0326434,0.0818142,0.0732692,0.0130015,-0.0444699,-0.016
 1408,0.0109421,0.1082788,0.0288131,-0.0023761,0.0061446,0.0750668,-0.0
 173736,-0.0082147,-0.0444723,0.0831778,0.1066566,-0.0302054,-0.0016132
 ,-0.007552,0.0766264,0.0174308,-0.0062381,0.0447267,0.0831256,0.002131
 8,-0.0501989,-0.0331638,-0.0786304,0.0792174,-0.0115348,-0.0435543,0.0
 181052,0.0110811,0.1852318,-0.0321766,-0.024234,0.0062881,0.1300809,0.
 0115877,-0.0101484,0.0303467,0.1658771,0.1333053,0.0308392,-0.0132231,
 0.0197454,0.1079698,0.0140305,-0.0155827,0.0540274,0.2086747\Polar=149
 .4224567,-0.0044173,148.3197837,-0.045356,-0.0000468,120.63171\Quadrup
 ole=5.3942845,5.2270752,-10.6213597,0.0085638,0.0783536,-0.0016125\PG=
 C01 [X(C6H24N6Rh1)]\NImag=0\\0.59134942,-0.08338651,0.49945467,0.02677
 710,0.06335324,0.52344394,-0.07591338,0.00805550,-0.01026327,0.4548153
 4,0.00468536,-0.08360967,-0.00339052,0.00286685,0.64001832,0.01224009,
 0.00976777,-0.20350163,-0.07007072,0.01143007,0.51884733,-0.01517261,-
 0.00171465,-0.00951294,-0.14556967,-0.00593438,-0.00400011,0.38999052,
 -0.00199848,-0.00024888,0.00068005,0.01531637,-0.08776226,-0.00734132,
 -0.12265268,0.54571177,-0.04559097,0.00092809,-0.01726123,-0.02359156,
 -0.00861325,-0.09065200,0.03415766,0.09178418,0.61016545,-0.01124861,-
 0.00869975,-0.00231030,-0.01023289,-0.01189023,0.00765548,-0.04839989,
 -0.00296015,0.00408475,0.35022815,-0.01148360,0.00306611,-0.00810346,-
 0.00972628,0.00143254,-0.00260097,-0.00371569,-0.06074833,0.00467693,-
 0.00002386,0.35504077,-0.00085679,-0.00603895,0.00545029,0.00497494,-0
 .00286914,0.00591660,0.00624740,0.00774821,-0.05495782,0.00172664,-0.0
 0013453,0.32784109,0.00018262,-0.00071473,-0.00056535,-0.00035030,0.00
 017211,-0.00018368,-0.00077414,0.00195528,0.00207295,-0.04812654,0.003
 11038,0.00609669,0.40104541,0.00013112,0.00011590,-0.00035333,0.000152
 38,-0.00008325,0.00013055,-0.00181780,0.00222926,0.00226594,0.00246647
 ,-0.06111669,-0.00797339,0.12904840,0.53458454,0.00046985,-0.00051735,
 -0.00007575,-0.00015732,-0.00023133,-0.00033857,0.00196179,-0.00236265
 ,-0.00208501,0.00416859,-0.00480650,-0.05507506,0.02989032,-0.09319845
 ,0.61059386,-0.00012094,0.00011565,0.00022092,-0.00001083,-0.00004013,
 0.00002126,-0.00036358,-0.00014150,-0.00014546,-0.00923126,0.01020619,
 0.00510501,-0.14590274,-0.01279731,-0.02312204,0.45482420,-0.00008065,
 -0.00060265,-0.00002752,0.00005081,0.00024906,-0.00009412,-0.00015904,
 -0.00007040,0.00023824,0.01240391,0.00047521,0.00262941,0.00847517,-0.
 08740224,0.00957400,0.00501578,0.63980526,0.00000540,0.00019888,0.0001
 7747,0.00002410,0.00009274,0.00011002,-0.00019038,-0.00012274,-0.00033
 883,0.00779691,0.00225414,0.00587662,-0.00365740,0.00753488,-0.0907324
 7,-0.07049996,-0.00857625,0.51902495,-0.00005010,0.00020361,-0.0004238
 7,-0.00012375,0.00006005,-0.00000411,0.00021207,-0.00013541,0.00049065
 ,-0.01043273,0.01205784,-0.00067830,-0.01499891,0.00260124,-0.04547664
 ,-0.07650168,-0.00499526,0.01168819,0.59839628,-0.00015829,0.00103940,
 -0.00050418,-0.00013458,-0.00059979,-0.00019727,0.00070428,0.00008958,
 0.00049379,0.00927272,0.00219840,0.00606047,0.00233647,-0.00040323,0.0
 0116884,-0.00838180,-0.08306308,-0.01035375,0.07903852,0.49222270,-0.0
 0040185,0.00052107,-0.00034394,0.00022177,0.00001792,0.00017749,-0.000
 54833,0.00037658,-0.00007729,-0.00200290,0.00822194,0.00541463,-0.0095
 0039,-0.00025773,-0.01704133,-0.01021465,0.00369566,-0.20348121,0.0238
 5626,-0.06476951,0.52315401,-0.00018550,0.00159340,-0.00076714,-0.0004
 1615,-0.00035405,-0.00047025,-0.00217388,0.00051229,-0.00163224,-0.060
 70722,-0.00465985,-0.00963955,0.00322492,-0.00234251,-0.00140351,-0.00
 581526,0.00858477,0.00404005,-0.09768561,0.01200054,0.00776711,0.40389
 670,0.00185394,-0.00057605,0.00145973,0.00002949,-0.00033257,0.0001394
 4,-0.00280429,0.00056468,-0.00246396,-0.00338150,-0.04857943,0.0013905
 6,-0.00291196,0.00065466,-0.00141546,0.00781527,-0.01134240,-0.0084682
 9,0.03335299,-0.13630014,0.00179070,0.12676346,0.53041125,-0.00161522,
 0.00147386,-0.00152330,-0.00022710,0.00001651,-0.00055598,0.00251532,-
 0.00092879,0.00238911,-0.00628388,0.00068712,-0.05569187,-0.00053280,-
 0.00184244,-0.00050464,0.02138042,-0.04037712,-0.01570193,0.01776111,-
 0.01416648,-0.08965427,-0.10206446,-0.01335847,0.61210779,-0.09976836,
 -0.01343356,0.00755382,-0.00654849,-0.00879849,0.00439314,0.00345718,0
 .00217976,-0.00119520,-0.06026962,0.00505977,-0.00972668,-0.00207101,-
 0.00037138,-0.00150560,-0.00040346,0.00035658,-0.00047754,-0.00033188,
 -0.00160273,-0.00082525,-0.00029114,-0.00204875,-0.00798859,0.39381650
 ,-0.03486127,-0.13445198,-0.00188362,-0.00801497,-0.01060427,0.0082581
 5,0.00278186,0.00048515,0.00135166,0.00380778,-0.04878400,-0.00090304,
 0.00295186,0.00043348,0.00252123,-0.00002694,-0.00034715,-0.00011809,-
 0.00186272,-0.00042716,-0.00142325,0.00252452,0.01085047,0.00169323,-0
 .12090285,0.54070730,0.01825355,0.01352478,-0.08986596,0.02306366,0.03
 950150,-0.01583569,-0.00044969,0.00175924,-0.00039206,-0.00611148,-0.0
 0038231,-0.05554236,0.00251638,0.00083857,0.00239154,-0.00022854,-0.00
 000700,-0.00055604,-0.00167550,-0.00140217,-0.00151946,-0.00805677,-0.
 00134700,0.00621109,-0.10122038,0.01755866,0.61219092,-0.00049586,0.00
 012234,0.00005416,0.00117562,0.00087030,-0.00064104,0.00768783,-0.0075
 8512,0.00532651,-0.05351573,-0.00261424,0.00164685,0.00091291,0.001871
 06,-0.00189456,-0.00037694,-0.00018867,0.00050842,0.00010322,-0.000146
 21,-0.00021541,0.00189784,0.00372183,-0.00300150,-0.00108775,-0.003516
 35,0.00297244,0.65686384,-0.00028284,-0.00008843,0.00042814,0.00078061
 ,-0.00183450,0.00146511,-0.00301783,0.00263529,0.00566991,-0.00754810,
 -0.05358648,0.00989652,-0.00104405,-0.00271359,0.00168823,0.00029887,0
 .00042900,-0.00021891,0.00003280,-0.00048453,-0.00007849,0.00008319,-0
 .00020055,0.00069835,0.00006268,-0.00020792,0.00013805,-0.07515714,0.3
 2550902,-0.00001260,0.00011897,-0.00039991,-0.00018931,0.00220328,-0.0
 0153533,0.00314388,0.00738216,0.00667959,0.00382524,0.00808423,-0.0567
 7181,-0.00147057,-0.00277104,0.00235266,-0.00032254,0.00057848,0.00008
 217,0.00023913,-0.00001973,-0.00004787,0.00106057,0.00236023,-0.002501
 11,-0.00055314,-0.00203903,0.00195797,0.04505810,0.02859355,0.56461919
 ,-0.00010534,0.00009407,0.00006315,0.00021004,-0.00017058,0.00006604,-
 0.00043804,0.00011287,0.00120822,0.00225628,-0.00507159,-0.00362549,-0
 .00043221,0.00032348,0.00027221,-0.00004040,-0.00003207,0.00026576,-0.
 00029018,0.00018511,0.00028883,0.00020058,-0.00074112,-0.00054347,-0.0
 0009590,-0.00027051,-0.00007057,-0.09335084,-0.00053911,-0.01009006,0.
 55769751,-0.00000792,-0.00037012,0.00011364,-0.00023568,0.00035563,0.0
 0008314,-0.00050150,0.00117627,0.00114992,-0.00416630,-0.01640418,0.00
 036146,0.00012902,-0.00047325,-0.00016908,-0.00013471,-0.00029952,0.00
 024651,-0.00012251,0.00010323,0.00020647,0.00046243,-0.00059448,-0.000
 63485,0.00012343,0.00038110,-0.00029098,0.00736029,-0.12873148,-0.0441
 4471,0.02316828,0.49902829,0.00026482,-0.00020515,-0.00006786,-0.00071
 907,0.00060648,-0.00055153,0.00176081,0.00061962,-0.00310634,-0.003240
 03,0.00406411,0.01113260,0.00020985,0.00011531,-0.00029259,0.00033436,
 -0.00006540,0.00031760,-0.00041392,0.00000700,0.00012033,0.00015368,-0
 .00075356,-0.00003062,-0.00046194,0.00006616,-0.00000059,-0.00209223,-
 0.01774721,-0.10311906,0.05386342,-0.09656336,0.55666963,-0.00003912,-
 0.00000943,0.00000623,0.00001986,0.00001646,0.00002369,0.00004828,0.00
 003229,-0.00006111,0.00012415,0.00089992,0.00042998,0.00203204,0.00005
 525,0.00178149,0.00101662,-0.00103949,-0.00169540,-0.29129987,-0.01376
 253,-0.08091791,-0.01165163,0.00411994,-0.00159272,0.00016423,-0.00008
 715,0.00009349,-0.00004559,-0.00005378,-0.00002417,0.00001403,0.000022
 43,0.00004880,0.30993543,0.00005834,-0.00031943,0.00018827,0.00011040,
 0.00014997,0.00012405,-0.00035060,-0.00000223,-0.00024458,-0.00002278,
 -0.00294406,-0.00244784,0.00022232,0.00074682,-0.00225447,-0.00397444,
 0.00001378,0.00219262,-0.02141691,-0.05050102,-0.00716467,0.03433690,-
 0.00763011,0.00799322,0.00063720,0.00043942,0.00085309,-0.00006934,0.0
 0008702,-0.00010748,-0.00000196,-0.00002059,0.00008515,0.01123621,0.05
 689471,0.00012133,-0.00018147,0.00010649,-0.00011211,0.00001858,-0.000
 09263,0.00019568,-0.00006730,0.00000601,-0.00017447,-0.00183911,-0.001
 64779,-0.00166160,0.00034340,-0.00735056,-0.02953543,-0.00161042,-0.00
 590287,-0.08177374,-0.00461968,-0.08027715,0.01226850,-0.00197457,0.00
 374686,0.00041254,0.00026558,0.00042467,0.00002989,-0.00000176,0.00001
 202,-0.00000604,0.00000986,0.00001979,0.08659787,0.00724798,0.08271574
 ,0.00002995,0.00002548,-0.00000119,-0.00016370,-0.00002781,-0.00001881
 ,-0.00014622,0.00010459,-0.00001369,0.00048922,0.00051882,0.00022786,0
 .00136333,0.00073656,0.00025504,-0.00072439,0.00149704,-0.00144747,-0.
 11048622,-0.09726536,0.05853630,0.00722650,0.01839422,-0.00809766,-0.0
 0006873,-0.00000208,-0.00000686,-0.00003179,-0.00006586,-0.00001900,0.
 00007115,0.00006721,0.00009924,-0.01197997,-0.02280387,0.01492455,0.11
 340921,-0.00008062,-0.00010594,0.00004949,0.00027769,0.00013060,0.0001
 7354,-0.00063770,0.00007763,-0.00026754,-0.00060976,-0.00052036,-0.000
 34086,0.00033926,0.00034155,0.00023715,0.00297758,0.00627799,-0.002076
 43,-0.09058271,-0.19732937,0.09046747,-0.01036873,-0.02840229,0.009869
 05,0.00022787,-0.00004967,0.00015611,0.00006017,0.00013631,-0.00003460
 ,-0.00012599,-0.00006603,-0.00014994,-0.00169129,-0.00018944,0.0011125
 5,0.09613519,0.22003632,0.00000873,-0.00000395,0.00001763,-0.00008435,
 -0.00007519,-0.00016368,0.00028335,0.00006196,0.00016170,-0.00052914,0
 .00057259,-0.00055810,0.00035880,-0.00040474,0.00249870,0.01743577,0.0
 2604845,-0.01869924,0.05743398,0.09676494,-0.10879078,-0.00471810,-0.0
 1266647,0.00422521,0.00009052,-0.00003226,0.00008157,0.00000490,0.0000
 2232,0.00007394,-0.00009693,-0.00007007,-0.00002911,-0.00441653,-0.007
 88961,0.00596089,-0.06442389,-0.09725366,0.11803979,0.00005894,0.00006
 963,-0.00000443,-0.00002080,-0.00004288,-0.00000660,0.00013037,0.00000
 294,-0.00004348,-0.00250207,-0.00139138,-0.00241530,-0.02360370,0.0280
 7364,0.00652763,-0.08550238,0.08390989,0.02767461,0.00175522,-0.002473
 03,0.00300649,0.00089214,-0.00041017,-0.00255184,0.00011816,0.00009309
 ,0.00019416,0.00015147,-0.00023337,-0.00006837,-0.00000570,0.00010618,
 -0.00000112,0.00010571,-0.00022798,0.00024894,0.00013518,0.00026091,-0
 .00015096,0.09945765,-0.00000857,0.00007632,-0.00001281,0.00002472,-0.
 00003169,0.00002014,0.00002173,-0.00005817,-0.00005220,-0.00050900,-0.
 00014875,-0.00072688,-0.00210138,0.00459550,0.00203669,0.09169735,-0.2
 6094800,-0.06969416,-0.00022148,-0.00166282,-0.00062496,-0.00053403,0.
 00184725,0.00039335,0.00002148,-0.00003561,-0.00002103,0.00006649,-0.0
 0003015,-0.00007263,0.00002477,0.00007422,0.00001224,0.00009631,0.0000
 2872,-0.00045629,-0.00016523,0.00073220,-0.00011029,-0.09654796,0.2723
 5311,0.00001742,0.00000405,0.00000284,0.00002270,-0.00000803,0.0000276
 8,-0.00001363,0.00000053,-0.00000769,-0.00150685,-0.00095569,-0.001718
 77,-0.00801854,0.01093842,0.00346823,0.03020294,-0.06959539,-0.0757153
 4,0.01185650,-0.02741833,-0.00494384,0.00123835,-0.00150489,-0.0074303
 0,0.00018116,-0.00001910,0.00012217,-0.00010119,0.00005610,-0.00007546
 ,-0.00008645,-0.00007290,-0.00012073,-0.00052924,0.00002300,0.00031688
 ,0.00056710,0.00051133,0.00140426,-0.02949106,0.07450992,0.07792127,0.
 00001977,-0.00021097,-0.00006902,-0.00002797,0.00006991,-0.00006318,0.
 00016209,0.00003958,0.00003168,-0.00036984,-0.00096335,-0.00040194,-0.
 02461561,-0.02545751,0.01167850,-0.11008690,-0.09042652,0.05714009,0.0
 0267357,0.00394325,-0.00062603,0.00013598,-0.00032322,-0.00001976,0.00
 013373,0.00001488,0.00007734,0.00008118,-0.00033393,-0.00010901,0.0001
 1439,0.00027896,0.00015654,0.00057478,0.00048641,0.00016460,0.00124973
 ,-0.00055427,-0.00156150,0.00754676,0.00787708,-0.00568282,0.12711780,
 -0.00000215,0.00002514,0.00000168,0.00002119,-0.00000810,0.00002112,-0
 .00000100,0.00001863,-0.00004036,0.00007476,0.00014130,0.00009574,0.00
 259108,0.00296250,-0.00286443,-0.09665676,-0.19782517,0.09085787,0.003
 71279,0.00274438,-0.00242787,0.00010746,0.00167845,0.00022591,-0.00003
 745,-0.00000004,-0.00005300,0.00040616,-0.00039313,-0.00004016,0.00002
 988,0.00002497,0.00006991,0.00002592,0.00030888,0.00074911,0.00037488,
 0.00108119,-0.00138652,-0.01395286,-0.01934762,0.01396757,0.10294058,0
 .20663220,0.00001420,-0.00003009,-0.00006380,-0.00001410,-0.00004503,-
 0.00001211,0.00007324,-0.00002535,0.00014573,0.00071059,-0.00021171,-0
 .00054008,-0.01029654,-0.01075984,0.00433696,0.06326546,0.09299728,-0.
 10810482,0.01632340,0.02696448,-0.01876310,-0.00056670,0.00022664,0.00
 248839,0.00002006,0.00001585,-0.00000038,-0.00016631,0.00019926,-0.000
 05133,-0.00001998,-0.00007670,-0.00009487,-0.00005455,-0.00014330,0.00
 138610,-0.00037604,-0.00219542,-0.00558292,-0.00478306,-0.00670091,0.0
 0547552,-0.06042607,-0.09903084,0.11769342,0.00185588,0.00230415,0.003
 03605,-0.09346072,-0.09117763,0.03077259,-0.02467815,-0.02678998,0.006
 44682,-0.00240545,0.00148873,-0.00238761,0.00012858,-0.00001075,-0.000
 04140,-0.00002016,0.00004240,-0.00000747,0.00005639,-0.00006878,-0.000
 00384,0.00011280,-0.00009990,0.00019503,0.00093384,0.00044919,-0.00256
 417,0.00007061,-0.00061996,0.00068875,-0.00005598,0.00010703,0.0002299
 8,-0.00000438,-0.00000388,0.00000935,0.00000190,-0.00002754,0.00000776
 ,-0.00001042,-0.00001182,0.00000009,0.00002173,-0.00000152,-0.00000389
 ,0.10817274,0.00008514,-0.00174402,0.00049203,-0.09895900,-0.25286917,
 0.06857176,0.00335839,0.00564736,-0.00231570,0.00060683,-0.00023034,0.
 00082715,-0.00003008,-0.00005692,0.00005397,-0.00002518,-0.00003248,-0
 .00001980,0.00000930,0.00007891,0.00001288,-0.00002750,-0.00003026,0.0
 0001280,0.00057238,0.00180517,-0.00028774,0.00016799,0.00048857,-0.000
 47296,0.00003744,-0.00013204,-0.00014488,-0.00000144,-0.00001159,-0.00
 000841,-0.00000047,0.00000689,-0.00000248,0.00001284,0.00001314,0.0000
 0325,-0.00000844,0.00000089,0.00001005,0.10367316,0.26350921,0.0130336
 1,0.02688046,-0.00496039,0.03330656,0.06837181,-0.07582700,-0.00851094
 ,-0.01060006,0.00348074,-0.00146451,0.00101845,-0.00171976,-0.00001307
 ,0.00000021,-0.00000808,0.00002299,0.00000712,0.00002773,0.00001728,-0
 .00000495,0.00000279,0.00018167,0.00001111,0.00012241,0.00130810,0.001
 44074,-0.00743525,-0.00001002,-0.00044200,0.00039817,-0.00001771,-0.00
 006749,0.00018925,-0.00000101,-0.00001172,0.00000567,0.00000961,-0.000
 01612,0.00002171,-0.00000005,-0.00000327,-0.00000553,0.00000003,-0.000
 00344,-0.00001231,-0.03279473,-0.07331920,0.07803537,0.00233612,-0.003
 90445,-0.00048797,-0.10223196,0.08641040,0.05302455,-0.02362526,0.0265
 5779,0.01179122,-0.00030655,0.00103581,-0.00041409,0.00016016,-0.00004
 508,0.00003289,-0.00003191,-0.00006884,-0.00006379,0.00002877,0.000209
 99,-0.00006909,0.00013487,-0.00002068,0.00007956,0.00015083,0.00038568
 ,-0.00001171,-0.00014177,-0.00019451,0.00013643,-0.00005720,0.00016829
 ,0.00004302,-0.00000932,-0.00006344,0.00001978,0.00001590,-0.00008463,
 0.00005529,0.00002209,0.00000751,0.00000016,0.00000205,-0.00000113,0.0
 0002058,0.00776770,-0.00906320,-0.00627086,0.11844430,-0.00367580,0.00
 303979,0.00242600,0.09264580,-0.20600150,-0.09306509,-0.00152552,0.002
 03680,0.00234564,-0.00001582,0.00011994,-0.00008232,-0.00000521,0.0000
 2078,0.00003926,-0.00002021,-0.00000411,-0.00001835,0.00000189,0.00001
 599,0.00000113,0.00003132,-0.00000079,0.00004954,-0.00004647,0.0016650
 9,-0.00025815,0.00004390,0.00003131,-0.00006035,0.00000784,-0.00004415
 ,-0.00001446,-0.00000269,-0.00000844,-0.00000419,-0.00000961,-0.000004
 70,-0.00000260,0.00000058,0.00000049,0.00000342,0.00000106,0.00000095,
 0.00000457,0.01278102,-0.01956102,-0.01366828,-0.09923915,0.21551783,0
 .01516666,-0.02767169,-0.01875439,0.05906622,-0.09545889,-0.10775696,-
 0.00980441,0.01121680,0.00430039,0.00069382,0.00015977,-0.00052676,0.0
 0007548,0.00002189,0.00014542,-0.00001246,0.00004561,-0.00001223,0.000
 01561,0.00002924,-0.00006388,0.00001869,-0.00001649,-0.00000067,-0.000
 57830,-0.00020785,0.00243526,-0.00007993,-0.00006144,0.00007491,0.0000
 0284,-0.00003358,0.00002972,-0.00000486,-0.00001928,0.00002762,0.00001
 693,-0.00003680,0.00003614,-0.00000426,-0.00000986,-0.00001228,0.00002
 044,-0.00000542,0.00000685,-0.00450471,0.00692647,0.00547711,-0.055968
 74,0.10141514,0.11741979,-0.28923777,0.02388492,-0.08068765,0.00124609
 ,0.00098284,-0.00178236,0.00201774,-0.00011005,0.00188331,0.00008314,-
 0.00102749,0.00052906,0.00006041,-0.00003520,-0.00005067,0.00001489,-0
 .00001072,0.00001848,-0.00004186,-0.00000235,-0.00000183,0.00014142,0.
 00010005,0.00005712,-0.01329428,-0.00388975,-0.00194024,-0.00003680,0.
 00007222,-0.00009358,0.00000168,0.00001643,-0.00003146,0.00000498,0.00
 001265,-0.00000679,-0.00000426,0.00001473,-0.00000616,-0.00000418,0.00
 000111,-0.00000053,-0.00000653,0.00000259,-0.00000406,0.00011227,-0.00
 010049,-0.00052929,0.00055245,-0.00003651,-0.00004986,0.30838926,0.031
 53289,-0.05241801,0.01059969,0.00389969,-0.00020164,-0.00211764,-0.000
 27949,0.00076489,0.00217066,-0.00010171,-0.00289813,0.00242476,0.00034
 940,-0.00001579,0.00024802,-0.00010511,0.00015529,-0.00012540,-0.00006
 987,-0.00031693,-0.00018828,-0.00062515,0.00046303,-0.00085697,-0.0340
 8609,-0.00601281,-0.00793238,-0.00000975,0.00010625,-0.00013624,-0.000
 02080,0.00008046,0.00005186,-0.00000851,0.00010156,0.00007447,-0.00001
 644,0.00003442,0.00000002,0.00000359,-0.00001179,0.00001178,0.00006354
 ,-0.00001130,0.00001959,0.00022523,0.00002393,0.00000046,-0.00049701,0
 .00033013,0.00014560,-0.02188993,0.05830078,-0.08165765,0.00808362,-0.
 08040167,-0.02944031,0.00286671,-0.00592453,-0.00167121,-0.00028285,-0
 .00735068,-0.00009412,0.00184791,-0.00165236,0.00019888,0.00005885,0.0
 0000588,-0.00011296,-0.00001380,-0.00009253,0.00012913,0.00017622,0.00
 010657,0.00040205,-0.00028411,0.00042609,0.01235915,0.00145779,0.00376
 200,-0.00010326,-0.00013440,0.00010422,-0.00001165,-0.00001485,0.00001
 835,-0.00000995,-0.00007417,-0.00002260,0.00000995,-0.00003602,-0.0000
 0463,0.00000971,0.00000802,0.00000565,0.00001997,0.00000338,0.00002758
 ,0.00026757,0.00044540,0.00031750,0.00013249,-0.00075386,0.00138619,0.
 08637163,-0.01091898,0.08284905,-0.10263559,0.09330799,0.05457859,-0.0
 0091436,-0.00116815,-0.00134364,0.00131157,-0.00078963,0.00021752,0.00
 045623,-0.00044576,0.00024077,-0.00019926,-0.00012156,-0.00001172,-0.0
 0017574,0.00004046,-0.00002600,0.00003186,-0.00003135,-0.00000344,-0.0
 0007815,0.00000317,-0.00001303,0.00661040,-0.01980634,-0.00853401,0.00
 003894,0.00009044,-0.00003216,0.00001797,0.00000592,-0.00006798,-0.000
 00423,0.00001809,0.00001147,-0.00001059,0.00001747,-0.00000917,0.00000
 243,0.00000066,0.00001031,0.00001945,0.00000833,0.00001840,0.00013208,
 0.00019093,0.00054236,0.00125844,-0.00038544,-0.00027574,-0.01092414,0
 .02326722,0.01483345,0.10578513,0.08666194,-0.20527733,-0.09267239,-0.
 00265781,0.00643479,0.00211191,-0.00038831,0.00038094,-0.00024274,0.00
 049028,-0.00053354,0.00027479,0.00066568,0.00003681,0.00025695,-0.0002
 6208,0.00014207,-0.00017099,0.00007592,-0.00010799,-0.00004892,-0.0002
 2637,-0.00003983,-0.00015548,0.00894235,-0.02816618,-0.00946706,0.0000
 3855,0.00009951,0.00001533,0.00001991,0.00000459,-0.00008297,-0.000012
 87,0.00003437,0.00003569,-0.00001509,0.00002548,-0.00000131,0.00002828
 ,0.00000549,0.00001550,0.00008425,-0.00000837,0.00003588,-0.00023422,0
 .00073383,-0.00053734,0.00054564,0.00107684,0.00220078,0.00215203,-0.0
 0125188,-0.00174301,-0.09162284,0.22850555,0.05321930,-0.09893629,-0.1
 0850606,0.01632238,-0.02679373,-0.01864575,0.00038105,0.00039005,0.002
 41132,-0.00056962,-0.00050437,-0.00056959,0.00027713,-0.00008503,0.000
 15447,-0.00008022,0.00007889,-0.00016350,0.00000910,0.00000364,0.00001
 783,0.00009220,0.00002839,0.00008193,-0.00425986,0.01284798,0.00419712
 ,0.00001912,-0.00002916,-0.00002247,0.00000264,-0.00005242,-0.00000558
 ,-0.00000613,0.00000024,-0.00000460,-0.00000858,0.00000233,-0.00001932
 ,0.00000795,0.00000203,0.00002171,0.00005573,0.00000028,0.00003615,-0.
 00014640,0.00011932,0.00140370,-0.00149380,0.00144558,-0.00559033,-0.0
 0408853,0.00808845,0.00596240,-0.06016305,0.09974737,0.11784310,0.0113
 2266,-0.01962003,-0.00496413,0.00029755,-0.00001796,-0.00102221,-0.000
 26009,0.00003629,-0.00000843,-0.00798683,0.01072957,0.00239429,-0.0002
 3346,-0.00036946,-0.00052348,0.00001904,0.00009815,-0.00003562,0.00027
 700,-0.00013403,0.00010040,-0.00066376,-0.00133099,-0.00173206,-0.1708
 0728,0.17992135,0.04912497,0.00037883,-0.00020390,0.00009350,-0.000214
 90,-0.00011471,0.00016443,0.00000983,-0.00000189,0.00000510,-0.0000121
 2,0.00002267,0.00000618,-0.00002496,0.00000120,0.00002668,-0.00000347,
 -0.00000394,0.00000824,-0.00003361,0.00006082,0.00011366,0.00005339,0.
 00033847,0.00032513,0.00093797,-0.00089600,-0.00026476,-0.00152583,-0.
 00394533,0.00162527,0.17275496,0.01544405,-0.02690192,-0.00637397,0.00
 048272,0.00035937,0.00039490,-0.00008901,-0.00022913,0.00011112,-0.000
 29042,0.00486039,0.00279689,-0.00015429,-0.00020692,-0.00024700,0.0000
 9400,0.00009154,-0.00003570,0.00001502,-0.00025714,-0.00009853,-0.0008
 9207,-0.00040768,-0.00121927,0.15867375,-0.27076123,-0.04662313,0.0002
 0889,-0.00016348,0.00000550,-0.00013469,0.00010931,0.00060585,0.000014
 79,0.00006518,0.00004510,0.00000379,0.00000935,0.00002244,-0.00000833,
 -0.00000975,0.00000962,0.00000548,-0.00000948,-0.00000327,-0.00031182,
 0.00024524,-0.00004329,-0.00000302,0.00010763,0.00078031,0.00002710,0.
 00182211,-0.00074899,-0.00362535,-0.00288356,0.00274898,-0.16959261,0.
 29507901,-0.00669509,0.00690276,0.00226096,-0.00132215,0.00124613,0.00
 099973,0.00008502,-0.00017334,-0.00031920,-0.00496715,0.00879863,0.003
 13028,0.00005832,-0.00028637,-0.00029758,-0.00014413,0.00000850,-0.000
 04990,0.00021963,-0.00023696,0.00001112,-0.00119064,-0.00122674,-0.001
 48061,0.03179420,-0.02836745,-0.06235805,0.00030317,0.00009921,0.00026
 930,-0.00005779,0.00029375,0.00019239,0.00001153,0.00005004,0.00004012
 ,-0.00001095,0.00003964,0.00001203,0.00002554,0.00001122,0.00003797,0.
 00001546,0.00000245,-0.00000103,0.00045205,-0.00039026,-0.00017265,0.0
 0049796,-0.00031571,-0.00066860,0.00004164,-0.00063013,0.00069042,0.00
 064909,0.00122997,0.00001925,-0.04471843,0.04868592,0.06619028,-0.0040
 8974,-0.00014545,0.01831765,-0.00169985,-0.00287956,-0.00011551,-0.000
 51888,-0.00015450,-0.00015757,0.00632142,-0.00092425,-0.01481746,0.001
 35406,0.00031595,0.00079026,-0.00051404,0.00000012,-0.00003932,-0.0001
 7108,-0.00060652,-0.00053524,-0.00303432,0.00005491,0.00079305,-0.0489
 6181,0.00344424,0.03964764,0.00067695,0.00068860,0.00044305,0.00026482
 ,-0.00050482,-0.00004280,-0.00002424,0.00027498,0.00017750,-0.00002191
 ,0.00005598,0.00003025,0.00009038,-0.00001885,0.00004277,0.00001821,-0
 .00001882,-0.00000011,0.00054356,-0.00002697,0.00070475,0.00002446,0.0
 0005068,-0.00034779,-0.00056425,-0.00003138,0.00064260,0.00121345,0.00
 061178,-0.00044608,-0.00478190,0.00117452,0.02496639,0.05691717,-0.005
 32415,0.00041013,0.03236339,-0.00390685,-0.00614042,0.00055116,-0.0001
 4177,0.00014609,-0.00041601,0.00014101,-0.00041456,-0.00121287,-0.0005
 2358,-0.00009992,-0.00006549,0.00044447,0.00000052,-0.00001163,-0.0002
 5508,0.00002758,0.00000763,-0.00004597,0.00034780,0.00012168,0.0041787
 0,-0.05738932,-0.00809256,0.00017464,0.00013696,-0.00021448,0.00012384
 ,-0.00033113,-0.00000022,0.00001465,0.00000394,-0.00003379,0.00001380,
 -0.00000531,0.00000693,-0.00003197,-0.00000436,-0.00000480,-0.00007148
 ,-0.00000353,-0.00001659,0.00037203,0.00010851,0.00182113,-0.00016211,
 0.00017247,-0.00024286,-0.00021788,0.00030444,-0.00021098,0.00084371,0
 .00025608,0.00023002,0.00655605,-0.00039500,-0.03438893,-0.00179824,0.
 06333128,0.00063444,-0.00002705,-0.00649812,0.00121778,0.00209122,0.00
 037442,-0.00006270,-0.00016253,0.00029528,-0.00116792,-0.00014559,-0.0
 0534209,0.00035672,0.00008181,0.00029881,-0.00018069,-0.00018421,-0.00
 020137,0.00000870,0.00012969,0.00007774,-0.00005777,-0.00008119,0.0007
 8938,0.07090265,-0.01032621,-0.39877086,0.00020976,-0.00006923,0.00019
 440,0.00002167,-0.00011340,-0.00013758,-0.00001289,-0.00003067,-0.0000
 0984,-0.00000904,0.00000218,-0.00001990,0.00006903,0.00002512,0.000052
 29,0.00000960,0.00002011,0.00003692,-0.00025860,-0.00022902,-0.0003702
 3,-0.00002757,-0.00002079,0.00029428,-0.00003834,-0.00034810,0.0002843
 2,-0.00074461,-0.00046794,0.00135143,-0.00001152,0.00048145,-0.0070408
 0,-0.07025112,0.00939980,0.41345491,0.00036388,0.00025896,0.00014815,-
 0.01836173,0.03324779,0.00688168,-0.09234492,0.11142335,0.01073613,0.0
 0610040,-0.00894383,-0.00302720,-0.00016769,-0.00005263,-0.00071532,-0
 .00020058,0.00028533,0.00042674,-0.00013505,-0.00147654,0.00065743,0.0
 0008287,0.00032606,-0.00062046,-0.00027474,-0.00010419,-0.00006198,-0.
 00172329,-0.00042753,0.00180736,0.00004081,0.00031396,0.00019026,0.000
 08829,0.00051498,-0.00019855,-0.00050631,0.00063965,-0.00059194,-0.000
 12451,-0.00003344,0.00003828,-0.00001552,0.00006390,-0.00013497,0.0011
 8198,-0.00011071,0.00076054,-0.00569977,-0.00089118,-0.00340981,0.0000
 6342,-0.00031792,-0.00006274,0.00029197,-0.00005702,-0.00073945,-0.000
 13369,-0.00008677,0.00006549,0.00001550,-0.00006027,-0.00000422,0.1105
 9994,-0.00014326,0.00002158,0.00104078,-0.00162029,0.00287011,0.000858
 24,0.13380502,-0.35146509,-0.05632003,0.00189211,-0.00952295,-0.000446
 35,0.00050628,0.00128528,-0.00062808,-0.00023640,0.00014653,-0.0000553
 6,-0.00015364,-0.00018359,0.00021886,0.00006770,-0.00011926,-0.0001776
 6,0.00002639,-0.00021202,0.00005370,-0.00088561,0.00043770,0.00078134,
 0.00008336,0.00016908,-0.00015185,0.00002374,0.00012981,-0.00006946,0.
 00008235,0.00054410,-0.00014683,0.00004223,0.00003430,-0.00002361,0.00
 006644,-0.00004282,-0.00001916,-0.00109901,0.00163506,-0.00022883,-0.0
 0131545,0.00146486,0.00004230,0.00000678,0.00014730,-0.00010478,0.0001
 8528,-0.00008377,0.00012747,-0.00003700,-0.00005711,-0.00000086,0.0000
 3852,0.00001795,0.00002395,-0.13326013,0.36015597,-0.00042198,0.001658
 76,0.00087249,-0.00300645,0.01036196,0.00215165,0.00391976,-0.03214648
 ,-0.05949221,-0.00488626,0.00844476,0.00268106,-0.00043687,0.00040384,
 0.00061841,0.00080092,-0.00020409,0.00034442,-0.00016702,-0.00003896,0
 .00011098,-0.00022500,-0.00014628,0.00020128,0.00011013,-0.00015679,-0
 .00031513,0.00174156,0.00031341,-0.00130655,0.00000919,-0.00024457,-0.
 00009711,0.00001646,-0.00004789,-0.00004953,-0.00014306,-0.00000730,0.
 00025440,0.00002129,0.00003132,-0.00002909,-0.00022084,-0.00001104,-0.
 00016876,0.00051489,-0.00036456,0.00081040,-0.00142949,0.00001686,-0.0
 0009984,0.00009553,-0.00058391,-0.00019127,0.00003185,-0.00053992,-0.0
 0069799,-0.00003460,-0.00006090,0.00004072,-0.00009739,0.00011280,-0.0
 0005345,-0.01419438,0.05363211,0.06285358,-0.00775819,-0.00017774,-0.0
 0061319,-0.00205228,-0.00628755,-0.03674665,-0.05068634,0.00787946,-0.
 00336650,0.00070040,0.00339658,0.00912521,-0.00030265,-0.00019979,0.00
 029284,0.00045833,0.00001026,0.00026344,-0.00047505,0.00000609,0.00012
 530,0.00054897,0.00051822,-0.00028613,-0.00014955,-0.00032742,0.000413
 87,-0.00064344,-0.00155255,-0.00065931,-0.00014744,-0.00016420,0.00059
 438,0.00002536,0.00007653,-0.00004213,-0.00007883,0.00026942,0.0000782
 0,-0.00006488,0.00000048,-0.00006504,-0.00007602,0.00000823,-0.0001023
 8,-0.00018879,-0.00050162,-0.00020956,0.00116889,0.00087724,0.00001650
 ,0.00042409,0.00050014,-0.00185742,0.00006631,-0.00020442,0.00036677,0
 .00000985,-0.00004891,-0.00005191,-0.00004999,-0.00005010,0.00005343,0
 .00139925,0.00288813,0.01641811,0.05837177,0.00105215,0.00010373,0.000
 50760,-0.00072512,-0.00048609,0.00138247,0.00600099,-0.05619884,-0.043
 88138,0.00170735,0.00478277,0.01206945,0.00011978,-0.00022371,-0.00014
 672,-0.00006585,-0.00013848,-0.00006014,-0.00013334,0.00038281,-0.0000
 8364,0.00054199,0.00036418,-0.00035292,-0.00034935,-0.00017454,-0.0000
 9456,-0.00141202,-0.00207881,-0.00070842,-0.00037158,0.00014547,0.0007
 7899,0.00001201,-0.00000998,0.00001249,0.00003909,-0.00004372,-0.00008
 914,0.00000070,0.00001460,-0.00002770,0.00005016,0.00000007,0.00004785
 ,-0.00035415,-0.00023000,-0.00066358,0.00067497,0.00036025,0.00052633,
 0.00006896,0.00023198,0.00037982,0.00000796,0.00009880,0.00014345,0.00
 004433,0.00003191,0.00014039,0.00007667,-0.00006400,0.00001151,-0.0014
 1198,-0.00793672,-0.03954176,-0.00550952,0.06286056,-0.00268169,0.0000
 2670,0.00024595,-0.00007381,-0.00078506,-0.00756442,-0.01766955,-0.071
 37800,-0.39833664,0.00105063,0.00086404,-0.00493792,-0.00001360,0.0000
 3822,-0.00007158,0.00009387,0.00004661,0.00001580,0.00004099,-0.000052
 41,-0.00012158,0.00003603,-0.00008117,0.00015245,0.00015504,-0.0000413
 8,0.00030595,0.00001673,-0.00002873,0.00074179,0.00000876,0.00008272,0
 .00011639,-0.00001627,0.00000366,0.00005590,0.00008007,-0.00007099,0.0
 0009628,-0.00001261,-0.00002086,-0.00001240,0.00001029,-0.00001270,-0.
 00000289,0.00027948,-0.00012593,0.00023312,0.00081900,0.00040718,0.001
 46289,0.00034683,0.00011613,-0.00042247,0.00002566,0.00000207,0.000302
 00,-0.00002020,0.00002571,-0.00005919,-0.00004159,-0.00003874,-0.00003
 506,-0.00007562,0.00026144,-0.00586984,0.01777415,0.07055978,0.4129286
 8,-0.00006518,0.00147259,0.00064386,-0.00020619,-0.00027015,0.00043052
 ,-0.00021358,0.00012017,-0.00063744,0.00642270,0.00834474,-0.00312260,
 -0.10353393,-0.12225082,0.01342920,-0.01968056,-0.03225488,0.00690123,
 0.00036433,-0.00027348,0.00010754,-0.00027267,0.00010389,-0.00006632,0
 .00007136,-0.00047256,-0.00058004,-0.00033551,0.00004371,0.00054001,-0
 .00004060,0.00002566,-0.00008503,0.00007715,0.00032207,-0.00005760,0.0
 0028645,0.00004198,-0.00074222,0.00123713,0.00012830,0.00077078,-0.005
 59323,0.00119257,-0.00340633,-0.00012495,0.00004079,0.00003876,-0.0000
 2148,-0.00006521,-0.00013468,0.00006851,-0.00051335,-0.00019519,-0.000
 54581,-0.00036670,-0.00051196,0.00002331,-0.00003235,0.00003637,-0.000
 25367,0.00024597,-0.00009806,0.00008358,-0.00071288,0.00144334,0.00018
 936,-0.00026445,0.00003789,0.12264934,0.00013738,-0.00025226,-0.000246
 48,0.00025408,0.00014820,0.00003701,-0.00041494,0.00130374,0.00059134,
 -0.00256694,-0.00981585,0.00069568,-0.14456004,-0.34021510,0.05651143,
 0.00259189,0.00418985,-0.00116754,0.00013208,0.00002633,-0.00103931,-0
 .00002694,-0.00021375,-0.00005039,-0.00007001,-0.00001781,0.00020272,0
 .00025053,0.00003933,-0.00035860,0.00000779,-0.00005041,0.00000172,-0.
 00000369,0.00013451,0.00010712,-0.00019857,-0.00008039,-0.00008973,0.0
 0111442,0.00158094,0.00019254,0.00162035,0.00135438,0.00010190,-0.0000
 3543,0.00003413,0.00002201,-0.00006781,-0.00003701,0.00002507,-0.00002
 224,0.00015373,0.00007811,0.00005616,0.00043152,0.00012868,-0.00005574
 ,-0.00005493,-0.00001827,0.00024065,-0.00020696,0.00008109,0.00073099,
 0.00098340,-0.00097619,-0.00026680,-0.00001565,0.00007875,0.14342338,0
 .34800557,-0.00016149,0.00004807,0.00011341,0.00081011,0.00016870,0.00
 034233,-0.00044774,-0.00038647,0.00066020,-0.00523649,-0.00821387,0.00
 273089,0.00559409,0.03262808,-0.05964080,-0.00344066,-0.01019439,0.002
 15792,-0.00048608,-0.00163939,0.00088109,0.00011196,0.00015238,-0.0003
 1337,-0.00020755,0.00015968,0.00019961,0.00023733,0.00024099,-0.000208
 24,0.00008231,-0.00014078,-0.00008508,0.00012054,0.00057882,-0.0001916
 6,0.00006130,0.00053469,-0.00068697,0.00052888,0.00034075,0.00080679,-
 0.00142975,0.00004143,-0.00009773,0.00001980,-0.00003243,-0.00002922,-
 0.00022033,0.00002058,-0.00016947,0.00001941,0.00004639,-0.00004994,-0
 .00007327,0.00001026,0.00027420,-0.00006415,-0.00003009,-0.00005599,0.
 00008993,0.00025475,0.00007720,0.00145991,0.00090937,-0.00200826,-0.00
 027298,0.00032840,-0.00009491,-0.01688827,-0.05366605,0.06294897,-0.00
 046822,0.00003303,0.00013018,0.00046034,-0.00003714,0.00026650,-0.0003
 0030,0.00020348,0.00029918,0.00049940,-0.00319616,0.00863871,-0.051303
 46,-0.00803885,-0.00173566,-0.00177492,0.00628428,-0.03678617,-0.00778
 370,0.00051655,-0.00062844,-0.00012311,0.00032584,0.00041749,0.0005196
 6,-0.00053226,-0.00027634,0.00045255,-0.00019984,-0.00034856,-0.000186
 66,-0.00006329,-0.00007530,0.00039859,-0.00050851,-0.00187226,0.000075
 14,0.00020494,0.00036054,-0.00014718,0.00049795,-0.00017956,0.00110238
 ,-0.00091054,-0.00000572,-0.00006491,0.00000303,-0.00006381,-0.0000785
 4,-0.00000492,-0.00010448,0.00002180,-0.00007869,-0.00004297,-0.000099
 28,-0.00026828,0.00008367,0.00018013,0.00014720,-0.00019007,-0.0012972
 7,0.00080150,-0.00011707,0.00021175,0.00025590,-0.00028580,-0.00013016
 ,0.00006928,-0.00000487,0.00133376,-0.00325294,0.01812005,0.05881104,0
 .00017048,0.00037795,0.00007678,0.00004018,-0.00014019,0.00004895,-0.0
 0011734,-0.00022597,0.00013526,-0.00154549,0.00499205,-0.01246141,-0.0
 0620733,-0.05540050,0.04339931,0.00078163,-0.00078961,0.00020757,-0.00
 071249,0.00012505,-0.00047928,0.00035102,-0.00020442,0.00007796,-0.000
 55259,0.00041237,0.00036657,-0.00066247,0.00108949,0.00117488,0.000083
 28,-0.00061354,-0.00022939,-0.00007589,0.00025710,-0.00029927,-0.00000
 820,0.00008954,-0.00016013,0.00034999,-0.00026573,0.00067253,-0.000701
 79,0.00042656,-0.00052506,0.00000274,0.00001454,0.00003057,-0.00004672
 ,0.00000250,-0.00004370,-0.00001331,-0.00000613,-0.00001066,-0.0000339
 4,-0.00002518,0.00008545,-0.00012767,-0.00008045,0.00004033,0.00104994
 ,0.00010854,0.00019416,0.00025561,-0.00003714,-0.00031619,-0.00006378,
 -0.00000078,-0.00000423,0.00104647,-0.00777945,0.03878773,0.00565786,0
 .06210741,0.00004468,0.00005044,-0.00012291,0.00009152,-0.00005031,0.0
 0001526,-0.00001416,-0.00003822,-0.00007295,0.00102839,-0.00091542,-0.
 00495991,-0.01482547,0.07148116,-0.39857179,-0.00005316,0.00077441,-0.
 00753189,-0.00266656,0.00009124,0.00025629,0.00015571,0.00003411,0.000
 30410,0.00003309,0.00008101,0.00015284,-0.00012797,0.00029672,0.000347
 96,0.00004513,-0.00006226,-0.00036587,0.00034091,-0.00013060,-0.000420
 01,0.00002575,-0.00000332,0.00030241,0.00028560,0.00011427,0.00023350,
 0.00080331,-0.00044095,0.00145933,-0.00001164,0.00002134,-0.00001245,0
 .00001093,0.00001232,-0.00000283,-0.00001628,-0.00000256,0.00005590,0.
 00008654,0.00006404,0.00009531,-0.00005201,-0.00006077,-0.00000666,0.0
 0020990,-0.00006068,0.00040447,0.00003197,-0.00008058,-0.00009543,-0.0
 0000458,0.00000438,-0.00003673,-0.00009717,-0.00025547,-0.00594737,0.0
 1493650,-0.07068270,0.41322266,0.00028160,0.00011103,0.00010495,0.0000
 1117,-0.00009455,-0.00003393,-0.00021054,0.00036966,-0.00051311,-0.008
 62332,-0.01009924,0.00223948,-0.00025626,-0.00003908,-0.00001950,0.000
 27606,0.00001651,-0.00103657,0.01144150,0.01798375,-0.00469916,-0.1850
 4301,-0.18359842,0.05114643,-0.00057027,0.00133871,-0.00167785,0.00120
 773,0.00011212,0.00014372,-0.00074404,0.00005852,-0.00055891,0.0009778
 6,0.00092805,-0.00023420,-0.00120512,0.00387785,0.00150529,-0.00002232
 ,-0.00004954,0.00011579,0.00004671,-0.00033257,0.00028712,-0.00002464,
 -0.00000054,0.00002619,-0.00000372,0.00000349,0.00000824,0.00000937,0.
 00000433,0.00000309,-0.00001309,-0.00002174,0.00000538,-0.00020326,-0.
 00014919,-0.00024036,-0.00040121,0.00000757,-0.00005943,0.00002724,0.0
 0005089,-0.00006267,0.00017745,0.00011606,-0.00005093,-0.00012797,0.00
 003989,-0.00003175,0.00000984,-0.00004370,-0.00002174,0.18712008,-0.00
 003756,-0.00026080,0.00009434,-0.00009046,0.00009968,0.00003697,0.0001
 5594,-0.00022851,0.00026918,0.00091133,0.00521897,-0.00285748,0.000092
 49,-0.00023460,-0.00011554,-0.00047737,0.00037127,-0.00035430,-0.01707
 089,-0.02696596,0.00659009,-0.16244580,-0.25637740,0.04448593,0.000898
 03,-0.00050286,0.00128945,0.00002711,-0.00024426,0.00016165,0.00119623
 ,0.00071354,0.00132367,0.00000799,0.00178807,0.00075844,0.00355300,-0.
 00319896,-0.00281613,0.00032203,0.00023388,0.00003665,-0.00000616,0.00
 013081,-0.00078954,0.00000901,-0.00001004,-0.00001070,-0.00000549,-0.0
 0000936,0.00000297,-0.00001236,0.00006558,-0.00004528,-0.00000287,0.00
 001068,-0.00002263,0.00016575,0.00018329,0.00017990,0.00032845,0.00004
 168,-0.00001535,0.00002649,-0.00005955,0.00003216,-0.00015890,-0.00007
 778,0.00006177,0.00009034,-0.00006204,0.00006253,0.00005002,0.00003181
 ,-0.00002420,0.17417368,0.28050999,0.00022972,0.00022676,0.00001132,-0
 .00014461,-0.00000204,-0.00005021,0.00007101,0.00028333,-0.00029769,-0
 .00538116,-0.00862114,0.00319257,0.00009761,0.00016745,-0.00032388,-0.
 00136700,-0.00119175,0.00099513,-0.00699026,-0.00659906,0.00226020,0.0
 3304760,0.02701513,-0.06230935,-0.00113678,0.00127640,-0.00147942,0.00
 038328,-0.00014815,0.00035666,-0.00024068,0.00079526,-0.00007547,0.000
 06852,0.00062663,0.00069156,0.00059379,-0.00125581,0.00002176,0.000467
 67,0.00036901,-0.00017421,0.00051544,0.00030284,-0.00067847,0.00002511
 ,-0.00001238,0.00003802,0.00001531,-0.00000318,-0.00000100,0.00000933,
 -0.00005034,0.00004008,-0.00001267,-0.00003917,0.00001211,-0.00024784,
 -0.00016929,-0.00025283,-0.00039240,-0.00001268,-0.00000304,0.00003801
 ,0.00001630,-0.00005602,-0.00019097,-0.00003205,-0.00000569,0.00006534
 ,-0.00000245,0.00004057,-0.00005788,-0.00013836,-0.00005954,-0.0468267
 7,-0.04674665,0.06610735,-0.00013350,0.00061357,-0.00053604,-0.0005336
 9,0.00002350,-0.00004002,0.00134432,-0.00038434,0.00078962,0.00633544,
 0.00067415,-0.01470164,-0.00050461,0.00018223,-0.00014297,-0.00141775,
 0.00267392,-0.00014499,-0.00384599,0.00033419,0.01692481,-0.04935732,-
 0.00379773,0.04005073,-0.00302570,0.00009057,0.00078977,-0.00026159,-0
 .00018142,-0.00009458,0.00000524,-0.00016696,-0.00007009,-0.00055407,0
 .00007109,0.00065203,0.00116290,-0.00065520,-0.00045363,0.00052787,0.0
 0000864,0.00062524,0.00002902,-0.00004526,-0.00033576,0.00009242,0.000
 01472,0.00004302,0.00002194,0.00001765,0.00000055,-0.00003665,-0.00027
 326,0.00017918,-0.00002477,-0.00005508,0.00002987,-0.00041446,-0.00030
 923,-0.00039124,0.00017471,0.00001570,0.00018821,-0.00027279,-0.000240
 16,0.00007866,-0.00140449,-0.00096483,0.00018899,0.00001680,-0.0000388
 0,-0.00010197,-0.00005126,-0.00007721,-0.00003980,-0.00509091,-0.00097
 124,0.02639546,0.05721291,0.00026181,-0.00000940,0.00001510,-0.0004213
 6,0.00001856,0.00001223,0.00044810,-0.00010765,0.00003252,-0.00040532,
 -0.00044399,0.00190585,0.00016834,0.00013147,0.00042086,0.00370516,-0.
 00641839,-0.00054074,0.00551340,0.00015638,-0.03311399,-0.00451203,-0.
 05705003,0.00639568,0.00018906,0.00034168,-0.00015521,0.00021208,-0.00
 017991,0.00027410,0.00009837,0.00038337,0.00031140,0.00025530,0.000288
 58,0.00018191,-0.00088149,0.00032509,-0.00021273,-0.00039120,0.0001220
 7,-0.00184826,0.00016806,0.00016743,0.00025714,0.00002790,-0.00000633,
 0.00000301,0.00007050,-0.00000741,0.00001668,-0.00001293,0.00001622,0.
 00002616,-0.00001306,-0.00000212,-0.00000817,0.00001171,0.00005512,0.0
 0002910,-0.00002392,-0.00001883,-0.00002504,-0.00024176,-0.00018769,-0
 .00025872,-0.00074613,0.00017396,0.00004494,0.00006035,0.00001693,-0.0
 0010833,0.00004973,-0.00006288,0.00004079,-0.00637152,-0.00006667,0.03
 329634,0.00205207,0.06314073,0.00000313,-0.00012973,0.00007808,-0.0001
 7161,0.00019213,-0.00020255,0.00034499,-0.00009788,0.00029726,-0.00117
 174,0.00022089,-0.00525983,-0.00005627,0.00016182,0.00028617,0.0011255
 3,-0.00214023,0.00037681,0.00064024,0.00000189,-0.00649220,0.07135974,
 0.00729570,-0.39878278,-0.00005464,0.00008338,0.00078985,-0.00011361,-
 0.00003520,-0.00010337,-0.00006654,-0.00000938,0.00002524,-0.00002400,
 0.00034783,0.00028200,-0.00071924,0.00050726,0.00135721,-0.00024806,0.
 00023949,-0.00037058,-0.00002637,0.00002234,0.00029502,0.00006809,-0.0
 0002802,0.00005244,0.00000905,-0.00002058,0.00003692,-0.00001154,0.000
 03120,-0.00000991,-0.00000904,-0.00000158,-0.00001979,-0.00005861,0.00
 001783,-0.00000275,0.00018918,0.00001707,-0.00000529,-0.00010020,-0.00
 007813,0.00007810,-0.00012710,-0.00017479,0.00039118,-0.00000499,-0.00
 002407,-0.00005313,0.00005271,-0.00001377,-0.00003521,-0.00003274,-0.0
 0048609,-0.00702976,-0.07062287,-0.00649179,0.41339622,-0.00029069,-0.
 00016790,0.00027874,-0.00003228,0.00002030,0.00025393,-0.00045139,-0.0
 0032536,0.00027894,0.00262887,0.00422989,-0.00364590,-0.00041756,-0.00
 004113,0.00115653,0.00022816,0.00017689,0.00006176,-0.00010975,-0.0001
 0596,0.00005848,-0.00008879,0.00029334,-0.00005758,0.00020960,0.000700
 60,-0.00051358,-0.00498816,0.00529354,0.00602843,-0.18748105,0.0142146
 9,0.03955661,0.00000193,0.00002439,-0.00001104,0.00001681,-0.00002053,
 0.00000494,-0.00006255,-0.00004061,-0.00001452,-0.00006502,-0.00000676
 ,0.00000464,-0.00001153,-0.00002080,-0.00008286,0.00009989,-0.00003258
 ,-0.00001582,0.00001313,0.00000081,-0.00000650,0.00007310,0.00011940,-
 0.00009347,-0.00078186,-0.00111877,-0.00026725,0.00000881,-0.00008163,
 -0.00006564,-0.00004243,-0.00000814,0.00008830,-0.00018877,-0.00010152
 ,0.00004784,0.00002358,-0.00007680,0.00001983,-0.00012327,0.00038293,0
 .00000475,-0.00020894,0.00015048,-0.00007293,0.00028123,-0.00015152,0.
 00002719,0.55567359,0.00013844,0.00010581,-0.00021771,0.00012190,-0.00
 030590,-0.00025657,-0.00012847,-0.00045349,0.00015596,0.00336461,-0.01
 682170,-0.00024406,0.00057244,0.00115604,-0.00120583,0.00024254,0.0003
 3705,-0.00008749,-0.00000271,-0.00036666,-0.00011661,-0.00010316,0.000
 37453,0.00029480,-0.00049439,-0.00060159,0.00065734,0.03502294,-0.0146
 0914,-0.01903243,-0.00914427,-0.07259109,0.00511712,-0.00001310,0.0000
 8027,0.00001535,-0.00000642,0.00000610,0.00005241,-0.00010998,-0.00012
 577,0.00006894,-0.00016771,-0.00003702,0.00003397,-0.00010217,0.000079
 42,0.00007615,-0.00028223,0.00003876,0.00007687,-0.00002383,-0.0000198
 4,-0.00000945,-0.00007262,-0.00006812,0.00007373,0.00002727,0.00075696
 ,-0.00077181,0.00018249,0.00037873,0.00001114,-0.00002586,-0.00004882,
 0.00013730,0.00004424,-0.00061273,0.00006086,-0.00030753,0.00018693,0.
 00024388,0.00017646,0.00012053,-0.00008348,0.00013403,0.00009454,-0.00
 029013,0.00047860,-0.00034749,0.00011318,-0.02562156,0.50133801,-0.000
 41249,0.00001040,0.00011959,0.00033773,0.00005071,0.00031680,0.0002051
 8,-0.00012506,-0.00029211,-0.00338251,-0.00393760,0.01111138,0.0017342
 9,-0.00069900,-0.00311058,-0.00074541,-0.00057589,-0.00055096,0.000274
 00,0.00019370,-0.00006820,-0.00046561,-0.00004519,-0.00000078,0.000186
 25,0.00074719,-0.00003074,0.02432667,-0.00888811,-0.01340657,0.0393107
 6,-0.00685256,-0.10212800,-0.00003364,-0.00005076,0.00001852,-0.000064
 38,0.00008583,-0.00000547,0.00023632,0.00013489,0.00018917,0.00004334,
 0.00001247,0.00002973,-0.00000184,-0.00001195,-0.00012036,0.00015268,-
 0.00007597,-0.00009350,0.00004505,-0.00008664,0.00001987,0.00010548,0.
 00014514,-0.00002881,-0.00058732,-0.00128712,-0.00006783,-0.00008313,-
 0.00030734,0.00002605,-0.00008531,0.00000185,-0.00008545,-0.00006496,0
 .00023223,-0.00036683,0.00019580,0.00014371,-0.00009690,0.00056036,-0.
 00080450,0.00011707,0.00013770,-0.00061399,0.00019474,-0.00004204,0.00
 000228,-0.00013800,0.05815559,0.09401494,0.55657785,0.00010452,0.00011
 881,-0.00021259,-0.00037799,0.00022265,0.00051368,0.00086679,-0.002020
 83,-0.00196329,-0.05305466,0.00259812,0.00096439,0.00814930,0.00735731
 ,0.00508461,0.00110001,-0.00100544,-0.00070736,-0.00048691,-0.00010764
 ,0.00003414,-0.00093705,0.00354213,0.00299471,0.00172889,-0.00380560,-
 0.00301537,0.00089140,-0.00035793,0.00120023,-0.00683125,-0.03542309,0
 .02476013,-0.00003895,0.00001567,-0.00009699,0.00003312,-0.00003695,0.
 00002068,0.00009271,-0.00015004,0.00000996,-0.00013460,-0.00003739,-0.
 00007758,0.00015748,-0.00007478,-0.00010291,0.00006988,-0.00042460,-0.
 00016706,-0.00004040,0.00007417,0.00002974,-0.00003150,-0.00005284,0.0
 0000360,0.00118048,-0.00007581,0.00038823,-0.00026223,-0.00020785,-0.0
 0011268,-0.00034717,-0.00023349,0.00022619,0.00049324,0.00068325,-0.00
 014002,-0.00165910,0.00097935,0.00172479,-0.00051891,0.00134700,0.0000
 1690,0.00042119,-0.00017744,0.00032218,0.00063642,-0.00020284,0.000212
 69,-0.09374384,-0.00890042,-0.00130609,0.66293756,-0.00005843,-0.00048
 887,0.00008722,-0.00025836,0.00043122,0.00018991,0.00088203,-0.0026645
 4,-0.00159475,0.00751566,-0.05421659,-0.00998467,0.00277544,0.00216549
 ,-0.00592078,-0.00091128,-0.00175909,-0.00143336,0.00030274,-0.0000943
 3,-0.00042831,-0.00003942,-0.00035766,-0.00027578,-0.00018274,-0.00003
 785,-0.00057227,0.00051923,0.00474133,0.00017275,-0.00563600,-0.012822
 50,0.00781889,-0.00006565,0.00010818,0.00013882,-0.00008684,0.00010563
 ,0.00002869,0.00063792,0.00046888,0.00044134,0.00020193,0.00002462,0.0
 0006465,0.00022373,-0.00003685,-0.00005067,0.00030312,-0.00038544,-0.0
 0017998,0.00005887,0.00008119,0.00000030,0.00007376,0.00013459,-0.0000
 2231,-0.00015957,-0.00023514,0.00016744,0.00018451,-0.00017974,0.00003
 844,-0.00002643,0.00005038,-0.00025229,0.00021725,0.00105431,-0.000288
 69,0.00051961,0.00037501,-0.00039067,0.00148665,-0.00220788,0.00003047
 ,0.00011635,-0.00014804,-0.00013140,-0.00071954,0.00018866,0.00006318,
 -0.00100504,-0.12838441,0.01786233,0.06003912,0.31965902,0.00023890,0.
 00000652,-0.00004814,-0.00034858,-0.00056233,0.00008152,-0.00134275,0.
 00283071,0.00235690,0.00352196,-0.00831800,-0.05671687,0.00281113,-0.0
 0752029,0.00668565,-0.00028652,-0.00219283,-0.00152988,-0.00001734,-0.
 00011783,-0.00039772,-0.00050729,0.00209900,0.00194691,0.00096036,-0.0
 0244838,-0.00249839,0.00114463,-0.00021402,-0.00197594,0.00687240,0.01
 876034,-0.01343208,-0.00008737,0.00014016,0.00010410,-0.00003229,-0.00
 001413,-0.00002243,0.00070826,0.00044289,0.00039678,0.00013892,0.00005
 489,0.00007442,-0.00006451,0.00007487,-0.00007564,-0.00010674,0.000043
 82,-0.00004838,-0.00002028,0.00010740,0.00001211,-0.00001736,0.0000341
 4,0.00007351,0.00009559,-0.00013345,0.00039831,-0.00010645,-0.00027016
 ,-0.00010648,0.00055524,0.00033447,-0.00020760,-0.00039401,-0.00115820
 ,0.00034722,0.00177303,-0.00086436,-0.00130947,-0.00062757,0.00073734,
 0.00074147,0.00007567,-0.00002240,0.00026665,0.00044175,0.00019752,0.0
 0018876,-0.00811481,0.04464849,-0.10309071,0.04368844,-0.03054836,0.56
 450841,-0.00000746,-0.00003882,-0.00002501,-0.00007481,0.00019347,-0.0
 0014799,0.00056130,0.00030710,-0.00026570,-0.00281239,-0.00233200,0.00
 139534,-0.00025683,-0.00011881,0.00004462,0.00094759,0.00030493,-0.000
 23814,-0.00008402,-0.00014950,-0.00014034,0.00045135,0.00041581,-0.000
 10214,-0.00006655,-0.00013820,0.00011788,-0.37818044,0.05280029,0.0799
 7170,0.00112613,-0.00025325,-0.00004992,-0.00000008,0.00008379,-0.0000
 5944,-0.00006563,0.00000515,0.00006846,-0.00018593,-0.00011757,0.00006
 348,-0.00011648,0.00044629,0.00014467,0.00005467,-0.00004127,0.0000405
 2,-0.00000239,-0.00000598,0.00001542,-0.00001480,-0.00000983,-0.000000
 95,-0.00001003,-0.00000928,-0.00000409,0.00004786,0.00005749,-0.000008
 18,-0.00001813,0.00003821,0.00000958,0.00008234,-0.00000181,-0.0000193
 8,0.00007590,0.00004716,0.00005233,-0.00015174,0.00002326,-0.00003431,
 0.00000084,-0.00048822,-0.00004147,0.00037347,-0.00014639,-0.00007779,
 -0.00016022,0.00000264,-0.00001341,0.00063472,0.00039778,0.00018855,0.
 00011906,0.00001035,-0.00011064,0.39725408,-0.00010889,0.00010020,0.00
 007476,0.00040761,-0.00000382,0.00002256,0.00062471,-0.00273172,0.0013
 9229,-0.01337362,0.00481734,0.00133758,0.00022099,0.00061155,-0.000647
 51,-0.00117135,-0.00107492,0.00087140,0.00020115,0.00029671,0.00047430
 ,0.00045591,0.00042210,-0.00067152,0.00011065,-0.00028128,0.00039515,0
 .02834707,-0.04798474,-0.01321445,0.03065728,-0.00510460,-0.00817196,0
 .00004177,-0.00009307,-0.00002176,0.00006980,-0.00005276,-0.00020833,0
 .00046378,0.00035885,-0.00028631,0.00120447,-0.00001618,-0.00050358,-0
 .00005712,0.00005613,-0.00004546,-0.00004053,0.00001079,-0.00002859,0.
 00000112,-0.00001761,-0.00003471,-0.00000124,-0.00002313,0.00000101,0.
 00010301,-0.00003562,-0.00001371,-0.00001678,0.00011558,0.00008501,-0.
 00055906,-0.00023315,0.00049327,-0.00014215,-0.00029964,-0.00004413,-0
 .00011055,0.00012135,-0.00002795,-0.00021515,-0.00101456,-0.00038676,0
 .00062462,0.00028418,0.00081203,0.00004393,0.00013899,-0.00004824,-0.0
 0098012,-0.00560503,-0.00303918,-0.00024960,-0.00052950,0.00027987,-0.
 05280681,0.05633235,0.00005603,0.00020384,-0.00010270,-0.00013247,-0.0
 0010030,0.00002197,-0.00045573,0.00148501,-0.00030251,0.00726056,-0.00
 236440,-0.00137923,-0.00009907,-0.00012130,0.00028053,0.00044539,0.000
 05751,-0.00018738,-0.00038960,0.00056244,0.00005225,0.00009463,-0.0001
 5224,0.00051439,-0.00027818,-0.00029773,-0.00007327,0.09746714,-0.0217
 2317,-0.07952919,0.01952567,-0.00188159,-0.00571256,0.00000089,0.00002
 948,-0.00004511,0.00005683,-0.00013675,-0.00007135,-0.00017840,-0.0001
 1809,0.00006418,-0.00015946,-0.00011847,0.00061183,0.00001568,-0.00001
 087,0.00002788,0.00001853,-0.00000101,0.00000369,-0.00000879,-0.000047
 08,0.00003783,-0.00000766,-0.00002417,0.00001942,0.00012494,0.00004917
 ,-0.00009196,0.00005443,0.00020752,0.00012306,0.00027776,0.00015880,-0
 .00020289,0.00004910,0.00004968,0.00002567,0.00001027,-0.00001192,-0.0
 0010374,-0.00025360,-0.00026223,0.00019612,-0.00083702,0.00040726,-0.0
 0179747,-0.00006406,-0.00037647,-0.00003777,-0.00054050,-0.00464092,-0
 .00241108,-0.00029941,0.00027477,0.00028881,-0.08649973,0.02204276,0.0
 8050619,-0.00043744,-0.00049233,-0.00005124,0.00038765,-0.00034163,0.0
 0052828,-0.00144931,-0.00129301,-0.00021637,0.00621854,0.00033551,0.00
 739720,0.00003929,0.00026741,-0.00015146,-0.00015217,-0.00001121,0.000
 00483,0.00002770,-0.00010351,-0.00001138,-0.00028007,-0.00017850,-0.00
 014070,0.00026338,0.00111384,-0.00047925,-0.13924202,0.02593000,-0.137
 05024,0.00209242,-0.00221603,0.00243921,0.00000251,0.00000946,0.000009
 52,-0.00002239,0.00003256,0.00000752,0.00005747,0.00004375,-0.00001284
 ,0.00003517,0.00000075,-0.00012093,-0.00022328,0.00008934,-0.00017129,
 -0.00005206,-0.00000209,-0.00000668,0.00005191,0.00003136,-0.00001304,
 0.00006562,0.00010351,-0.00002663,-0.00076547,-0.00028458,0.00029559,-
 0.00074345,-0.00113307,-0.00045601,-0.00020362,-0.00004852,0.00013381,
 -0.00000236,0.00001396,-0.00011830,0.00003916,0.00001733,0.00008398,0.
 00025883,0.00018753,-0.00009540,-0.00001910,-0.00007582,0.00024175,-0.
 00002972,0.00003479,0.00001130,0.00180212,-0.00038613,0.00119710,-0.00
 036957,-0.00001722,-0.00013574,-0.02104590,0.00512191,-0.03600357,0.15
 332002,-0.00014675,-0.00050659,0.00000104,0.00028015,-0.00043957,0.000
 55378,-0.00199517,-0.00097756,-0.00059843,0.00783595,-0.00125989,0.012
 08825,0.00009763,0.00047372,-0.00027284,0.00039778,-0.00013707,-0.0000
 8249,-0.00017867,0.00016474,0.00006173,-0.00047124,-0.00037174,0.00022
 766,0.00029168,0.00126330,-0.00079516,0.03937872,-0.05026256,0.0459781
 7,-0.01946996,0.00037809,-0.03020207,0.00002054,-0.00001574,-0.0000444
 8,0.00001806,-0.00001215,-0.00002109,-0.00003391,-0.00001142,0.0000398
 6,-0.00001143,-0.00001835,0.00007738,-0.00022774,0.00008436,-0.0001738
 5,-0.00004257,-0.00000184,-0.00002092,0.00006241,0.00009758,-0.0000436
 2,0.00001992,0.00000900,0.00000012,-0.00026036,0.00005289,-0.00015022,
 -0.00167332,-0.00068090,-0.00037686,-0.00016886,-0.00002131,0.00011328
 ,0.00004650,0.00010848,-0.00012286,-0.00010380,0.00003529,-0.00010780,
 0.00039471,-0.00109922,-0.00001201,-0.00028527,-0.00009933,-0.00028566
 ,-0.00002175,-0.00013394,0.00001953,-0.00069879,0.00055291,0.00016112,
 0.00005102,-0.00022471,0.00009204,0.00258295,-0.00030234,0.00605392,-0
 .02748565,0.05767420,-0.00003225,0.00032923,-0.00033113,0.00003557,0.0
 0001271,-0.00000255,0.00036713,0.00012698,0.00062363,-0.00196201,0.002
 77805,-0.00571099,-0.00001108,-0.00005677,-0.00001834,0.00005833,-0.00
 006082,-0.00009676,-0.00002194,0.00013255,0.00000859,0.00015968,0.0001
 0377,0.00002916,-0.00024805,-0.00087017,0.00076077,-0.16094327,0.02810
 501,-0.31398351,-0.01011310,0.00097628,-0.01598833,-0.00001216,-0.0000
 1692,-0.00001938,-0.00000982,-0.00000602,-0.00000910,-0.00000392,-0.00
 001505,0.00004984,-0.00006126,0.00002826,0.00008723,0.00001549,0.00000
 967,0.00002067,0.00002443,0.00000770,-0.00001993,-0.00003050,-0.000107
 52,0.00006780,-0.00001109,-0.00005135,0.00004570,0.00044593,0.00020275
 ,0.00009014,0.00027306,0.00005475,0.00045146,-0.00000145,0.00003252,0.
 00001648,-0.00008079,-0.00011286,0.00000381,0.00004075,-0.00000565,-0.
 00001989,-0.00000944,-0.00004854,0.00025353,0.00006795,-0.00004895,-0.
 00012149,-0.00001559,-0.00002282,-0.00002935,0.00025608,0.00058457,-0.
 00050404,0.00014997,-0.00001437,-0.00018258,0.00658362,-0.00069054,0.0
 0904970,0.16274395,-0.02894114,0.32320542,0.00007373,-0.00004086,-0.00
 001056,-0.00006495,0.00003350,-0.00003514,0.00005936,0.00003739,-0.000
 01231,-0.00055509,-0.00065845,-0.00019074,-0.00002409,-0.00001308,-0.0
 0003077,0.00001682,0.00004413,-0.00003285,0.00019815,-0.00012003,-0.00
 017307,-0.00023604,0.00067903,0.00020751,0.00001488,0.00000541,0.00007
 088,0.00497866,0.00105976,0.00597585,-0.19557606,-0.00094264,-0.133825
 82,-0.00000095,0.00003385,0.00000391,-0.00004830,0.00006232,0.00003558
 ,0.00000080,-0.00001179,0.00001839,0.00001257,-0.00001142,0.00000918,0
 .00001025,-0.00000489,0.00001035,-0.00000196,0.00000544,-0.00000091,-0
 .00000337,0.00002233,-0.00000573,-0.00001338,-0.00001871,0.00000515,0.
 00009301,0.00018723,0.00004670,-0.00002733,-0.00001322,0.00000050,0.00
 000593,-0.00000725,-0.00000867,-0.00001256,-0.00000747,0.00000820,-0.0
 0001651,-0.00000479,-0.00000880,0.00001132,-0.00002425,-0.00001326,0.0
 0068895,-0.00013156,0.00003260,0.00002772,-0.00011574,0.00002712,-0.02
 523566,0.00167073,-0.02001184,0.00218054,0.00043017,-0.00030879,0.0011
 7876,-0.00037058,-0.00015196,0.00086160,0.00168500,0.00148746,0.210706
 11,-0.00000592,0.00001114,0.00004594,0.00000680,-0.00003940,-0.0000038
 9,-0.00005348,-0.00015955,0.00009087,0.00004422,0.00025865,-0.00090289
 ,-0.00004019,0.00007195,0.00007863,-0.00007896,0.00007405,-0.00001119,
 0.00022597,-0.00015119,-0.00014980,-0.00014891,-0.00003246,0.00011648,
 0.00007723,-0.00007412,0.00009456,-0.02249866,-0.00584266,-0.02586545,
 0.00487793,-0.05076538,0.00559698,-0.00000481,0.00001190,0.00002105,-0
 .00003846,0.00006871,0.00004717,0.00001470,-0.00000390,0.00001221,0.00
 000366,0.00000036,-0.00002378,-0.00001314,0.00000981,0.00000638,-0.000
 01830,0.00000003,0.00001070,-0.00000456,-0.00000234,-0.00000840,-0.000
 00042,0.00000624,-0.00000890,-0.00001117,-0.00009209,-0.00005128,0.000
 15413,0.00009234,0.00000322,-0.00003559,-0.00001971,0.00002494,-0.0000
 2823,-0.00005720,0.00001353,-0.00000784,-0.00000638,0.00001939,-0.0000
 2347,0.00013916,-0.00001996,0.00063752,-0.00090416,0.00030188,0.000067
 54,-0.00000164,0.00010068,0.00101470,-0.00078560,0.00284509,-0.0003229
 6,0.00069655,-0.00088094,-0.00066605,0.00162017,0.00048580,0.00028780,
 -0.00511765,-0.00268833,-0.00300436,0.05709910,-0.00001528,0.00004653,
 0.00002540,0.00003072,-0.00006249,0.00003780,-0.00013590,-0.00015023,0
 .00007631,0.00024370,0.00038408,-0.00029009,0.00003563,0.00002266,0.00
 001129,-0.00011234,-0.00003463,-0.00004152,0.00013075,-0.00000259,-0.0
 0010660,-0.00016495,0.00044917,0.00005546,0.00007910,-0.00002997,0.000
 03638,-0.01144690,-0.00389395,-0.01565877,-0.12956173,0.00114023,-0.16
 911443,-0.00000724,-0.00000723,0.00001799,-0.00002986,0.00005263,0.000
 02055,0.00002128,0.00000857,0.00001018,-0.00000544,-0.00001668,-0.0000
 2331,-0.00001803,0.00001221,-0.00000907,-0.00000092,0.00000075,0.00000
 230,0.00000098,-0.00000761,-0.00000269,0.00000496,0.00000932,-0.000005
 16,-0.00002480,-0.00007737,-0.00004562,0.00008945,0.00007128,0.0000060
 7,-0.00004201,-0.00000555,0.00001759,-0.00002327,-0.00001869,-0.000007
 33,0.00001104,-0.00000090,0.00000981,-0.00001306,0.00008178,0.00000196
 ,0.00028971,-0.00032096,0.00049270,0.00005576,0.00007764,0.00001082,0.
 01381064,0.00088489,0.01243847,-0.00061006,-0.00068590,0.00133472,-0.0
 0053227,-0.00001956,-0.00004597,0.00072959,-0.00347248,-0.00018870,0.1
 4007156,0.00504775,0.18305159,-0.00000133,-0.00005821,0.00002867,-0.00
 006721,0.00007383,0.00000018,0.00008577,0.00010197,-0.00025907,-0.0005
 7360,0.00042570,0.00110549,0.00005961,-0.00015728,-0.00003765,0.000001
 20,-0.00000671,-0.00005034,0.00010181,-0.00005488,-0.00010213,-0.00005
 052,0.00024759,0.00020911,0.00003812,0.00012242,-0.00003245,0.00087862
 ,0.00316189,-0.00190776,-0.05589347,-0.02292018,0.01930285,0.00000037,
 0.00001761,0.00000387,-0.00002894,0.00003644,0.00002456,0.00001312,0.0
 0000456,0.00001008,0.00002036,0.00000206,-0.00000992,0.00002934,-0.000
 02753,-0.00000599,0.00004325,-0.00000642,-0.00000373,0.00000119,0.0000
 0355,0.00000138,0.00000212,0.00000597,-0.00001164,0.00000307,-0.000033
 04,0.00008171,-0.00001029,-0.00005872,-0.00000177,0.00001780,-0.000008
 09,-0.00003220,0.00002222,0.00011602,-0.00000917,0.00001635,-0.0000137
 4,-0.00002304,0.00001908,-0.00001187,-0.00001109,0.00030073,-0.0004302
 9,0.00008440,-0.00001925,-0.00002094,0.00002924,-0.00044205,-0.0221427
 7,0.01617982,-0.00592822,-0.00164193,0.00317846,0.00002423,0.00056422,
 -0.00043276,0.00046259,-0.00068380,0.00002314,0.00356600,0.01874855,-0
 .01531122,0.05606520,-0.00005408,0.00000038,0.00001356,0.00010777,-0.0
 0010238,0.00005701,-0.00023017,-0.00002276,0.00049402,0.00091031,-0.00
 106247,-0.00243653,-0.00011984,0.00002854,0.00017962,-0.00004108,0.000
 04712,-0.00001093,0.00006142,-0.00001915,-0.00003948,-0.00007334,0.000
 24886,-0.00002041,0.00008835,0.00001781,0.00001423,-0.00252778,-0.0277
 7657,0.00952390,-0.02362218,-0.20985725,0.12717204,-0.00000533,-0.0000
 0638,0.00000120,-0.00001555,0.00002341,0.00000683,-0.00000597,-0.00000
 886,0.00000760,-0.00002174,-0.00001070,0.00001173,-0.00004254,0.000028
 60,-0.00002075,-0.00003625,0.00000523,0.00000665,0.00000054,-0.0000034
 6,-0.00000559,0.00000738,0.00001025,0.00000157,-0.00005558,-0.00006823
 ,-0.00003455,0.00001367,-0.00001393,0.00002307,-0.00002113,0.00001519,
 0.00002265,-0.00009165,-0.00017229,0.00000181,0.00000812,-0.00001649,0
 .00001818,-0.00002256,0.00008064,0.00005872,0.00011638,-0.00016544,0.0
 0000785,0.00003509,-0.00005999,0.00000813,-0.00269541,0.00307936,0.000
 08381,0.00234979,0.00153937,-0.00148776,-0.00009561,-0.00044290,0.0002
 8756,-0.00002358,0.00077240,0.00066978,0.00040698,0.00213424,0.0001331
 2,0.02599791,0.23079460,-0.00006252,0.00005297,-0.00000146,0.00023207,
 -0.00021298,0.00016459,-0.00067252,-0.00041383,0.00092434,0.00153223,-
 0.00133911,-0.00272317,-0.00010031,0.00010487,0.00008651,-0.00008996,0
 .00000915,-0.00003745,0.00013099,-0.00000615,-0.00005083,0.00001767,0.
 00028773,0.00005546,0.00009520,0.00001675,-0.00006575,-0.00331085,-0.0
 2466129,0.01134775,0.02104272,0.13497851,-0.15630998,-0.00001036,-0.00
 001484,-0.00000624,-0.00003508,0.00004280,0.00000380,0.00000276,-0.000
 00348,0.00002588,-0.00001923,-0.00000731,0.00002410,-0.00008319,0.0000
 4925,-0.00005645,-0.00004079,0.00001082,-0.00000371,0.00000858,-0.0000
 0756,-0.00000206,0.00001417,0.00000996,0.00001260,-0.00003035,-0.00005
 904,-0.00002469,-0.00001768,-0.00002629,0.00005719,-0.00007329,0.00003
 251,0.00005464,-0.00015009,-0.00024372,-0.00002981,0.00000042,0.000003
 80,0.00003356,0.00000305,0.00002830,0.00008935,0.00027319,-0.00037043,
 0.00006443,0.00003600,-0.00008962,0.00000226,-0.00153599,0.01034699,-0
 .00749497,0.00355679,-0.00018467,-0.00037330,-0.00021036,0.00022216,0.
 00051240,0.00000020,-0.00007209,0.00217264,0.00244283,0.01593292,-0.01
 205824,-0.02259473,-0.13465711,0.16275771,0.00010049,0.00004994,-0.000
 10003,0.00000364,0.00000858,-0.00004973,0.00007192,0.00015515,-0.00004
 558,-0.00063329,-0.00044438,0.00121263,0.00009137,-0.00010764,-0.00028
 147,-0.00007566,-0.00007517,-0.00000214,0.00000356,0.00005809,0.000028
 09,0.00002871,-0.00012320,-0.00003311,-0.00005670,-0.00023248,0.000209
 31,-0.00594365,0.00197651,0.00323995,0.00066130,0.02225282,0.01615934,
 0.00000102,-0.00000373,0.00000166,0.00000154,-0.00000563,-0.00001173,0
 .00003251,0.00002747,-0.00000518,0.00004519,0.00000479,-0.00000416,0.0
 0001312,-0.00000550,0.00000974,0.00002102,-0.00000324,-0.00001035,-0.0
 0000020,-0.00001795,0.00000385,-0.00002956,-0.00003395,0.00002413,0.00
 031216,0.00040709,0.00008325,-0.00001983,0.00001935,0.00002889,0.00001
 659,0.00001226,-0.00002382,0.00002072,0.00001446,-0.00001369,0.0000190
 5,0.00000789,-0.00003312,0.00002094,-0.00012458,-0.00000907,0.00000621
 ,0.00002992,0.00008358,-0.00000838,0.00005856,-0.00000277,-0.05413481,
 0.01597750,0.01361320,0.00079322,-0.00442567,-0.00232596,0.00008269,0.
 00131577,0.00125458,-0.00033297,0.00014598,0.00011846,0.00112396,0.000
 36426,-0.00088681,0.00044202,-0.00048545,0.00009167,0.05411076,-0.0000
 6642,-0.00001888,0.00004375,0.00004316,0.00004494,0.00001302,0.0001182
 1,0.00001577,-0.00017751,-0.00092995,-0.00100190,0.00238915,0.00022538
 ,-0.00002844,-0.00048291,-0.00010916,-0.00009455,-0.00005674,0.0000541
 1,-0.00000452,-0.00001483,-0.00008923,0.00002736,-0.00001300,0.0000864
 0,0.00025458,0.00001101,-0.00201757,0.00155597,0.00134394,0.00280237,0
 .00196820,-0.00080574,-0.00000072,-0.00000331,0.00000555,-0.00000699,0
 .00001090,-0.00000106,0.00004242,0.00002560,0.00002095,0.00003450,0.00
 000347,-0.00000660,0.00000498,-0.00000883,-0.00000799,0.00002013,-0.00
 001115,-0.00001112,0.00000507,-0.00000573,-0.00000135,0.00001785,0.000
 02409,-0.00000785,-0.00013555,-0.00017803,-0.00001037,-0.00003676,-0.0
 0005934,-0.00000935,-0.00000956,-0.00001672,-0.00001719,0.00002522,0.0
 0007899,-0.00005852,0.00002084,0.00001397,-0.00002110,0.00008328,-0.00
 017071,-0.00000123,0.00005339,-0.00007230,0.00003102,-0.00001386,-0.00
 001598,-0.00002315,0.01668119,-0.21165621,-0.12788362,0.00125992,-0.02
 769329,-0.00942546,-0.00027144,0.00058058,0.00021511,0.00015018,-0.000
 07763,-0.00019309,-0.00006293,0.00025952,0.00004608,0.00047242,0.00014
 833,-0.00000233,-0.01812776,0.23280018,0.00013047,0.00000080,-0.000050
 52,-0.00009030,-0.00000537,-0.00003722,-0.00010516,-0.00010018,0.00008
 637,0.00159295,0.00126834,-0.00272417,-0.00065430,0.00044385,0.0009254
 3,0.00024141,0.00020307,0.00016416,-0.00006483,-0.00005017,-0.00000138
 ,0.00009436,-0.00002054,-0.00006579,0.00000594,-0.00028813,0.00005543,
 0.00356269,0.00002545,-0.00037152,-0.00199386,-0.01027616,-0.00749810,
 0.00000888,0.00000722,-0.00000210,0.00001372,-0.00001053,0.00001261,-0
 .00008536,-0.00004567,-0.00005637,-0.00004123,-0.00000907,-0.00000360,
 0.00000290,0.00000333,0.00002580,-0.00001874,0.00000801,0.00002376,-0.
 00000971,0.00001513,-0.00000625,-0.00003676,-0.00004117,0.00000368,0.0
 0028834,0.00035639,0.00006411,0.00003981,0.00008804,0.00000218,0.00000
 031,-0.00000376,0.00003363,0.00000180,-0.00002830,0.00008954,-0.000074
 41,-0.00002929,0.00005455,-0.00013943,0.00025000,-0.00003007,-0.000027
 78,0.00006032,-0.00002454,-0.00001678,0.00002718,0.00005729,0.01501152
 ,-0.13576303,-0.15627068,-0.00221303,0.02479479,0.01134849,-0.00009110
 ,-0.00078268,-0.00034807,-0.00034330,0.00020634,0.00044460,-0.00002108
 ,0.00035495,0.00089107,0.00009156,-0.00000173,-0.00014019,-0.01657278,
 0.13551193,0.16271277,0.00019089,0.00010423,-0.00016362,0.00001874,-0.
 00004102,-0.00003252,-0.00002116,0.00001717,-0.00003413,-0.00055869,0.
 00068094,-0.00014927,0.00005995,-0.00004767,-0.00001654,-0.00006640,-0
 .00003237,-0.00003495,0.00007581,0.00003802,-0.00001275,0.00001076,-0.
 00001080,0.00006647,-0.00025062,-0.00065783,0.00020016,0.00219748,-0.0
 0046178,-0.00028290,-0.02529023,-0.00059244,-0.02011299,-0.00000410,-0
 .00002229,-0.00000530,-0.00001253,0.00001948,0.00000564,0.00001105,0.0
 0000481,0.00001006,-0.00000141,-0.00000530,-0.00000131,0.00000069,0.00
 001162,0.00001771,0.00001303,0.00001136,0.00000989,-0.00000193,-0.0000
 3244,0.00000301,-0.00004857,-0.00005641,0.00003324,0.00061554,0.000082
 34,0.00001936,0.00003298,0.00012101,0.00002731,-0.00001602,0.00000521,
 -0.00000960,0.00001361,0.00003011,-0.00001243,0.00000777,0.00000582,-0
 .00000977,-0.00001090,0.00000545,0.00000761,0.00008381,-0.00019545,0.0
 0004864,-0.00003362,0.00001923,0.00000033,-0.19559988,0.00735310,-0.13
 397899,0.00590356,-0.00159407,0.00703659,0.00027386,-0.00032525,-0.000
 05176,-0.00063708,0.00070822,0.00074720,-0.00357567,0.00064926,0.00369
 438,0.00110850,0.00002579,-0.00003487,0.00271458,-0.00043416,0.0017306
 0,0.21080503,-0.00024036,-0.00014676,0.00015845,0.00008185,0.00007256,
 0.00001221,0.00004492,0.00006891,-0.00007784,0.00005022,0.00029176,0.0
 0089469,0.00004383,-0.00015976,-0.00008986,-0.00000552,-0.00003760,0.0
 0000566,0.00000303,0.00000936,-0.00004542,-0.00008146,-0.00007046,-0.0
 0009792,0.00016098,0.00002123,-0.00012256,0.00024187,0.00065363,0.0009
 1192,0.00007326,-0.00071716,-0.00195252,0.00000464,-0.00000157,0.00000
 863,0.00000132,0.00000544,0.00000868,0.00001302,0.00000903,-0.00000691
 ,0.00001828,-0.00000042,-0.00001071,-0.00001485,-0.00000373,-0.0000129
 7,-0.00000443,0.00000083,0.00002336,0.00000561,0.00001369,-0.00002115,
 0.00004389,0.00006928,-0.00004856,-0.00070515,-0.00098082,-0.00032640,
 -0.00006704,-0.00000194,-0.00009972,0.00000835,-0.00000687,-0.00001903
 ,0.00002912,0.00013705,0.00002015,0.00003422,-0.00002133,-0.00002439,0
 .00002623,-0.00005853,-0.00001376,0.00000304,-0.00008435,0.00004975,-0
 .00014909,0.00009883,-0.00000361,0.00151181,-0.05093034,0.00031509,0.0
 2197892,-0.00676158,0.02552710,-0.00005882,0.00000814,-0.00005501,0.00
 025292,0.00025541,-0.00012906,-0.00043516,0.00126101,0.00062039,-0.000
 40052,0.00027464,-0.00035261,-0.01878005,0.00298177,-0.01602596,-0.003
 82632,0.05719832,0.00012932,-0.00000331,-0.00010608,-0.00011076,0.0000
 3920,-0.00004088,0.00003412,-0.00002385,0.00001142,0.00023961,-0.00038
 889,-0.00028690,-0.00012920,0.00015625,0.00007609,0.00003339,0.0000611
 6,0.00003766,-0.00001748,-0.00004585,0.00002545,0.00008024,0.00002681,
 0.00003617,-0.00018119,-0.00043461,0.00005569,-0.00061001,0.00069751,0
 .00135394,0.01376374,-0.00149029,0.01245108,0.00000128,0.00000765,-0.0
 0000270,0.00000453,-0.00000958,-0.00000521,-0.00001854,-0.00001140,-0.
 00000903,-0.00000101,-0.00000067,0.00000236,0.00002083,-0.00000955,0.0
 0001012,-0.00000451,0.00001630,-0.00002317,-0.00000715,0.00000708,0.00
 001790,-0.00003186,-0.00005121,0.00002029,0.00022481,0.00026342,0.0004
 4618,0.00005190,-0.00008215,0.00000862,0.00001110,0.00000042,0.0000098
 9,-0.00001676,-0.00008114,0.00000208,-0.00004162,0.00000743,0.00001759
 ,-0.00002221,0.00001951,-0.00000733,-0.00002194,0.00007896,-0.00004608
 ,0.00008632,-0.00007529,0.00000600,-0.12950820,0.00456242,-0.16907597,
 -0.01129570,0.00438808,-0.01572047,-0.00004416,0.00026909,0.00020051,-
 0.00030884,0.00003848,-0.00012918,0.00366581,-0.00078440,-0.00101154,-
 0.00088913,-0.00000708,0.00089053,-0.01530017,0.00054057,-0.01205195,0
 .13985973,-0.01116271,0.18307838,-0.00008583,0.00016781,-0.00015816,0.
 00097846,-0.00039712,-0.00027103,-0.00023617,0.00012252,0.00007594,-0.
 00213743,0.00262580,0.00135782,0.00051354,-0.00045321,-0.00032777,-0.0
 0010138,-0.00018937,-0.00014860,-0.00000084,0.00004287,-0.00002861,-0.
 00006732,0.00013099,0.00010138,0.00041482,-0.00040634,-0.00008892,0.00
 012690,-0.00003801,-0.00012214,0.00064766,-0.00067601,0.00032376,-0.00
 001447,0.00000972,0.00000061,-0.00000989,0.00000847,-0.00000426,0.0000
 5902,0.00004128,0.00004247,-0.00000037,0.00000650,0.00001676,-0.000199
 85,0.00014230,0.00007556,-0.00016001,-0.00041744,0.00015549,-0.0000054
 4,-0.00008728,-0.00005796,-0.00006862,-0.00000398,0.00007747,0.0003328
 2,0.00014266,-0.00013572,-0.00016062,0.00001092,-0.00001094,-0.0001472
 7,-0.00001048,-0.00003352,0.00003103,0.00044433,-0.00002637,0.00010651
 ,-0.00001326,-0.00004139,0.00007952,-0.00006394,0.00005444,0.00004091,
 -0.00006057,-0.00000786,-0.00002069,-0.00003262,0.00000577,-0.00023659
 ,0.00003113,0.00031393,-0.38095247,-0.03782840,0.08068851,-0.00003617,
 -0.00003684,-0.00002291,0.00000196,0.00000392,0.00003889,0.00029039,0.
 00004612,-0.00005510,0.00003786,0.00029558,-0.00005622,0.00000252,0.00
 007518,-0.00022085,0.00122775,0.00068520,-0.00052947,0.40111916,-0.000
 18459,0.00029824,-0.00046705,0.00108955,-0.00110058,-0.00087122,-0.000
 20082,0.00051586,0.00068242,0.01367225,0.00421572,-0.00142181,-0.00076
 771,-0.00268849,-0.00138062,-0.00040401,0.00002284,-0.00001546,0.00011
 368,0.00009311,-0.00007344,-0.00011956,-0.00028332,-0.00040028,-0.0004
 5322,0.00046123,0.00070919,0.00022244,-0.00054001,-0.00027512,0.000700
 08,-0.00561948,0.00303255,-0.00000120,-0.00001791,0.00003475,0.0000007
 8,-0.00002353,-0.00000061,0.00005687,0.00005180,0.00004358,0.00004116,
 0.00000888,0.00002777,-0.00043827,0.00037089,0.00028145,-0.00119062,0.
 00007473,0.00044672,-0.00004506,-0.00008677,0.00002470,-0.00006858,-0.
 00004972,0.00020390,-0.00062008,0.00029033,-0.00080753,-0.00003069,0.0
 0014134,0.00004924,0.00012393,0.00011541,0.00003036,0.00016659,-0.0010
 4412,0.00039183,0.00054388,-0.00025760,-0.00049184,0.00012631,-0.00030
 402,0.00004189,-0.00010563,-0.00002947,0.00001479,0.00002487,0.0001160
 5,-0.00008589,-0.03087398,-0.00373949,0.00819395,-0.01338706,-0.045010
 90,0.00964248,0.00003669,-0.00004177,-0.00007973,0.00001473,0.00001234
 ,-0.00003512,0.00031292,-0.00000773,-0.00026685,-0.00129208,0.00062602
 ,0.00078632,-0.00058463,-0.00041909,-0.00021420,0.00038738,0.00157071,
 0.00004304,0.03732661,0.05227470,-0.00041315,-0.00054239,0.00005212,0.
 00045073,-0.00008081,-0.00019681,-0.00013434,0.00012373,0.00028824,0.0
 0739915,0.00207094,-0.00145395,-0.00052044,-0.00146470,-0.00030166,-0.
 00012834,0.00010637,0.00002206,0.00004789,-0.00020648,-0.00010249,-0.0
 0026572,0.00031164,-0.00007183,0.00010373,0.00015799,0.00057865,-0.000
 30710,-0.00026321,0.00028811,-0.00033580,0.00465941,-0.00241326,-0.000
 00678,0.00004744,0.00003779,-0.00000657,0.00002450,0.00001947,0.000016
 10,0.00001014,0.00002792,0.00001864,0.00000025,0.00000367,-0.00017307,
 0.00012524,0.00006397,-0.00019182,0.00011444,0.00059780,0.,-0.00002881
 ,-0.00004473,0.00006293,0.00013337,-0.00007117,-0.00083930,-0.00037898
 ,-0.00177990,-0.00004749,0.00037776,-0.00003708,0.00001113,0.00001045,
 -0.00010381,-0.00024271,0.00027250,0.00019749,0.00027023,-0.00017094,-
 0.00020282,0.00004711,-0.00005211,0.00002561,0.00012433,-0.00005517,-0
 .00009198,0.00004523,-0.00021085,0.00012326,0.01959599,0.00101849,-0.0
 0572680,0.09853754,0.01735846,-0.07963550,-0.00001922,0.00008059,-0.00
 006014,0.00015686,0.00004050,-0.00003566,-0.00004946,0.00005787,0.0002
 0051,0.00124416,-0.00027061,-0.00034725,-0.00044565,-0.00026825,0.0005
 1399,-0.00017926,-0.00048042,-0.00004861,-0.08760646,-0.01819320,0.080
 61804,0.00004029,0.00010869,-0.00001455,-0.00016855,0.00001311,0.00000
 762,0.00002702,-0.00024641,-0.00013786,0.00581936,-0.00069705,0.006744
 80,-0.00130251,0.00130604,-0.00019028,0.00038911,0.00030508,0.00050246
 ,-0.00041205,0.00048863,-0.00005090,0.00017210,-0.00101094,-0.00040491
 ,-0.00025171,0.00017180,-0.00014979,-0.00037143,0.00002622,-0.00014591
 ,0.00185549,0.00032469,0.00119312,0.00004798,-0.00002908,-0.00001102,0
 .00005980,-0.00010624,-0.00002643,-0.00021658,-0.00007633,-0.00016328,
 -0.00004965,0.00000416,-0.00000607,0.00005680,-0.00004661,-0.00001441,
 0.00003447,-0.00000167,-0.00012334,0.00000113,-0.00001031,0.00001152,-
 0.00002456,-0.00003214,0.00000834,-0.00000252,0.00007212,0.00025436,-0
 .00003045,-0.00003917,0.00001029,0.00004358,-0.00001698,0.00008900,0.0
 0021502,-0.00026055,-0.00009206,-0.00019351,0.00005625,0.00012867,-0.0
 0000486,-0.00000931,-0.00011279,-0.00073417,0.00030833,0.00031126,-0.0
 0066752,0.00113723,-0.00047098,0.00304134,0.00209913,0.00376578,-0.142
 14453,-0.02184186,-0.13897484,0.00000118,-0.00001413,0.00015422,0.0000
 2003,-0.00006213,-0.00006939,-0.00070760,-0.00021490,-0.00030206,-0.00
 034568,-0.00013825,-0.00035213,0.00049425,0.00003589,0.00000353,0.0007
 6342,-0.00054774,0.00088317,-0.02136940,-0.00419292,-0.03621910,0.1559
 1494,0.00018406,0.00015151,-0.00006164,-0.00039647,-0.00011877,0.00008
 091,-0.00007454,0.00048644,0.00027636,-0.00812706,-0.00085772,-0.01240
 160,0.00201136,-0.00112341,0.00060871,-0.00031703,-0.00044154,-0.00057
 605,0.00014415,-0.00053605,0.00000191,-0.00022957,0.00126247,0.0007666
 0,0.00046535,-0.00039997,-0.00021964,-0.00004368,-0.00022376,-0.000096
 49,0.00064497,0.00051253,-0.00021638,-0.00006059,0.00010207,0.00004436
 ,-0.00002163,0.00001580,0.00000153,0.00024135,0.00007801,0.00018124,0.
 00004452,-0.00000379,0.00002149,0.00003092,-0.00001097,-0.00003910,0.0
 0000782,-0.00001712,-0.00007081,-0.00002138,-0.00001439,0.00004403,-0.
 00001745,-0.00001004,0.00002047,0.00028206,-0.00011190,0.00027551,0.00
 001709,-0.00013275,-0.00001998,0.00010307,0.00003030,0.00010429,-0.000
 43823,-0.00106483,0.00004650,0.00017687,-0.00003169,-0.00011949,-0.000
 04164,0.00011164,0.00012793,0.00031355,0.00002390,0.00013896,0.0016429
 3,-0.00075979,0.00044861,0.01935996,-0.00057550,0.03004774,-0.03536264
 ,-0.04758553,-0.03987513,-0.00000368,0.00001331,-0.00004719,0.00005426
 ,-0.00016321,-0.00003951,-0.00067701,0.00024822,-0.00001546,-0.0001336
 9,-0.00006575,-0.00019135,0.00069463,0.00074237,0.00007082,-0.00194495
 ,-0.00501840,0.00343863,-0.00164502,0.00000383,-0.00443518,0.02313734,
 0.05548447,-0.00002770,-0.00013115,0.00000896,0.00006141,0.00005842,-0
 .00009719,-0.00000519,0.00005801,-0.00001774,-0.00208866,-0.00263424,-
 0.00572077,0.00036227,-0.00014363,0.00062364,0.00003450,-0.00001407,-0
 .00000237,-0.00004632,-0.00032824,-0.00033222,-0.00018481,0.00082440,0
 .00073556,0.00015469,-0.00011235,0.00002992,0.00015178,0.00000458,-0.0
 0018674,0.00022238,-0.00059551,-0.00050566,-0.00002626,0.00010950,0.00
 006802,-0.00000910,0.00005327,0.00004617,0.00001521,-0.00001025,0.0000
 2089,0.00002399,-0.00000867,-0.00001979,-0.00000322,0.00001513,0.00004
 982,-0.00006291,-0.00002418,0.00008690,-0.00001136,0.00001748,-0.00001
 937,-0.00000930,0.00000623,-0.00000913,0.00007233,0.00004684,-0.000117
 48,-0.00001444,0.00002353,-0.00002929,0.00004141,0.00000401,-0.0000195
 0,-0.00000468,0.00005239,0.00026109,-0.00000246,-0.00003250,0.00001623
 ,-0.00007581,0.00011655,0.00000382,0.00043211,-0.00021648,0.00009230,0
 .00021287,-0.00003037,0.00044140,-0.01015412,-0.00053028,-0.01599389,-
 0.16211947,-0.02096131,-0.31378314,0.00003957,0.00003311,-0.00003405,-
 0.00006749,0.00004290,0.00000974,0.00077220,0.00009022,-0.00013993,0.0
 0012711,0.00018792,0.00044580,-0.00000499,-0.00067173,0.00217307,0.001
 60501,0.00262301,-0.00019286,0.00662547,0.00039905,0.00906673,0.163963
 97,0.02167840,0.32304105\\0.00000609,-0.00001239,0.00002913,0.00001041
 ,-0.00002022,0.00003469,-0.00001588,-0.00001481,0.00000882,0.00014760,
 -0.00011084,-0.00010256,-0.00005961,0.00001971,0.00001859,-0.00001412,
 0.00000746,-0.00000858,-0.00000276,-0.00000191,0.00000879,-0.00002948,
 0.00002842,0.00000872,0.00000089,0.00002810,0.00001348,-0.00001020,0.0
 0001440,-0.00005255,0.00000778,0.00002618,0.00000436,-0.00000192,-0.00
 000027,0.00000684,-0.00000049,0.00000752,-0.00000345,0.00000222,-0.000
 00185,0.00000314,0.00000473,-0.00000686,-0.00001044,-0.00000237,0.0000
 0007,-0.00000490,0.00000838,-0.00000193,-0.00002293,0.00000140,0.00000
 085,-0.00000639,0.00001289,-0.00002290,-0.00000677,-0.00003452,-0.0000
 1263,-0.00001388,-0.00001377,0.00000243,-0.00000362,-0.00000812,-0.000
 02194,0.00001346,0.00001277,0.00000696,0.00001793,-0.00000894,0.000011
 91,0.00000916,0.00000003,0.00000618,0.00000619,-0.00007027,0.00003116,
 -0.00002251,-0.00001658,-0.00000035,-0.00000470,-0.00000078,0.00000841
 ,0.00000440,0.00001770,-0.00003379,0.00000340,0.00000760,0.00000737,0.
 00000201,0.00001806,0.00000423,0.00002957,0.00001668,0.00000344,0.0000
 3410,0.00000290,0.00000029,0.00000181,-0.00000109,0.00000117,-0.000000
 74,0.00000452,0.00001538,-0.00000699,0.00000120,0.00003199,0.00001259,
 0.00000704,-0.00000095,-0.00000015\\\@


 REFRAIN FROM ILLUSIONS, INSIST ON WORK AND NOT WORDS,
 PATIENTLY SEEK DIVINE AND SCIENTIFIC TRUTH.
 LAST WORDS OF MARIA MENDELEEVA TO HER SON DMITRI, C. 1850
 Job cpu time:       1 days 11 hours 52 minutes 37.8 seconds.
 Elapsed time:       0 days  2 hours 14 minutes 43.1 seconds.
 File lengths (MBytes):  RWF=    791 Int=      0 D2E=      0 Chk=     22 Scr=      2
 Normal termination of Gaussian 16 at Thu Jul  8 21:37:15 2021.
